cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide

C157H234N14O17 — CID 159133736

IUPACcis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide
SMILESCC.CC(C)(C)C(=O)[C@@H](NC(=O)C1CC1c1ccccn1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)C1C[C@@H]1c1ccccn1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)C1C[C@@H]1c1cccnc1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)[C@@H]1CC1c1ccccn1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)[C@@H]1CC1c1cccnc1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)[C@@H]1C[C@@H]1c1ccccc1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)[C@@H]1C[C@@H]1c1ccccn1)C(C)(C)C.COc1ccccc1C1C[C@H]1C(=O)N[C@H](C(=O)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C21H31NO3.C20H29NO2.6C19H28N2O2.C2H6/c1-20(2,3)17(18(23)21(4,5)6)22-19(24)15-12-14(15)13-10-8-9-11-16(13)25-7;1-19(2,3)16(17(22)20(4,5)6)21-18(23)15-12-14(15)13-10-8-7-9-11-13;2*1-18(2,3)15(16(22)19(4,5)6)21-17(23)14-10-13(14)12-8-7-9-20-11-12;4*1-18(2,3)15(16(22)19(4,5)6)21-17(23)13-11-12(13)14-9-7-8-10-20-14;1-2/h8-11,14-15,17H,12H2,1-7H3,(H,22,24);7-11,14-16H,12H2,1-6H3,(H,21,23);2*7-9,11,13-15H,10H2,1-6H3,(H,21,23);4*7-10,12-13,15H,11H2,1-6H3,(H,21,23);1-2H3/t14?,15-,17-;14-,15-,16-;13?,14-,15-;13-,14?,15-;12?,13?,15-;12?,13-,15-;12-,13?,15+;12-,13+,15+;/m11111100./s1
InChIKeyKHFIUZCZJQFJMD-IIFWPAHNSA-N
MW2589.68 g/mol
LogP28.89
Rot. Bonds33

About cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide

cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide (PubChem CID 159133736) has the molecular formula C157H234N14O17 and a molecular weight of 2589.68 g/mol. Its IUPAC name is cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Namecis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide
PubChem CID159133736
Molecular FormulaC157H234N14O17
Molecular Weight2589.68 g/mol
Exact Mass2587.79
IUPAC Namecis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide
SMILESCC.CC(C)(C)C(=O)[C@@H](NC(=O)C1CC1c1ccccn1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)C1C[C@@H]1c1ccccn1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)C1C[C@@H]1c1cccnc1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)[C@@H]1CC1c1ccccn1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)[C@@H]1CC1c1cccnc1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)[C@@H]1C[C@@H]1c1ccccc1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)[C@@H]1C[C@@H]1c1ccccn1)C(C)(C)C.COc1ccccc1C1C[C@H]1C(=O)N[C@H](C(=O)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C21H31NO3.C20H29NO2.6C19H28N2O2.C2H6/c1-20(2,3)17(18(23)21(4,5)6)22-19(24)15-12-14(15)13-10-8-9-11-16(13)25-7;1-19(2,3)16(17(22)20(4,5)6)21-18(23)15-12-14(15)13-10-8-7-9-11-13;2*1-18(2,3)15(16(22)19(4,5)6)21-17(23)14-10-13(14)12-8-7-9-20-11-12;4*1-18(2,3)15(16(22)19(4,5)6)21-17(23)13-11-12(13)14-9-7-8-10-20-14;1-2/h8-11,14-15,17H,12H2,1-7H3,(H,22,24);7-11,14-16H,12H2,1-6H3,(H,21,23);2*7-9,11,13-15H,10H2,1-6H3,(H,21,23);4*7-10,12-13,15H,11H2,1-6H3,(H,21,23);1-2H3/t14?,15-,17-;14-,15-,16-;13?,14-,15-;13-,14?,15-;12?,13?,15-;12?,13-,15-;12-,13?,15+;12-,13+,15+;/m11111100./s1
InChIKeyKHFIUZCZJQFJMD-IIFWPAHNSA-N
XLogP28.89
TPSA455.93 Ų
H-Bond Donors8
H-Bond Acceptors23
Rotatable Bonds33
Heavy Atoms188
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002589.68
LogP ≤ 528.89
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1023

Analyze cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide with MolForge

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Related Compounds

N-[2-(azetidin-1-yl)ethyl]-4-[4-(4,4-difluoro-3-oxopentyl)-2-pyridinyl]-N-ethylbutanamide;4-[4-[(cyanomethylamino)methyl]-2-pyridinyl]-N,N-dimethylbutanamide;4-[4-(2-cyclopropylethyl)-2-pyridinyl]-N-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]butanamide;4-[4-[4-(dimethylamino)butyl]-2-pyridinyl]-N,N-dimethylbutanamide;N-[[2-[[[2-[2-(dimethylamino)ethyl-ethylamino]-2-oxoethyl]amino]methyl]-4-pyridinyl]methyl]-2,2-difluoropropanamide;N-[2-(dimethylamino)ethyl]-N-ethyl-2-[(4-ethyl-2-pyridinyl)methylamino]acetamide;N-[2-(dimethylamino)ethyl]-N-ethyl-4-[4-(4,4,5,5,6,6-hexafluoro-3-oxoheptyl)-2-pyridinyl]butanamide;N,N-dimethyl-2-[[4-(propylaminomethyl)-2-pyridinyl]methylamino]acetamide;1-[(4-ethyl-2-pyridinyl)methylamino]-3-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]propan-2-one
CID 160732457
ethane;(3Z)-2-imino-3-(2-methoxyphenyl)-3-(methylhydrazinylidene)-N-[[4-(2-methyl-4-pyridinyl)cyclohexyl]methyl]propanamide;N-[(Z)-[2-imino-1-(2-methoxyphenyl)propylidene]amino]methanamine;N-[[4-(2-methyl-4-pyridinyl)cyclohexyl]methyl]formamide
CID 142279769
(3S)-4-[6-(3,5-difluoro-2-methoxyphenyl)-3-pyridinyl]-3-(methylamino)butan-2-one;(3S)-4-[6-(2-fluorophenyl)-3-pyridinyl]-3-(methylamino)butan-2-one;(3S)-3-(methylamino)-4-[6-(3-methylphenyl)-3-pyridinyl]butan-2-one;(3S)-3-(methylamino)-4-[6-(2-propan-2-ylphenyl)-3-pyridinyl]butan-2-one
CID 157399274
(3R,6S,9R,12R)-6-butan-2-yl-3,8,9-trimethyl-12-(2-methylpropyl)-2-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),18,20-triene-7,10,13-trione;(3R,6S,9R,12R)-6-cyclopropyl-22-fluoro-3,8,9-trimethyl-12-(pyridin-3-ylmethyl)-2-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(18),19,21-triene-7,10,13-trione;(3R,6S,9R,12R)-6-cyclopropyl-3,8,9-trimethyl-12-(2-methylpropyl)-2-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),18,20-triene-7,10,13-trione;(3R,6S,9R,12R)-6-cyclopropyl-3,8,9-trimethyl-12-(pyridin-2-ylmethyl)-2-oxa-5,8,11,14-tetrazabicyclo[16.4.0]docosa-1(22),18,20-triene-7,10,13-trione
CID 157425950
bis(3,3-dimethyl-N-[2-(3-methylphenyl)ethyl]butanamide);bis(3,3-dimethyl-N-[2-(4-methylphenyl)ethyl]butanamide);3,3-dimethyl-N-[2-(2-methyl-4-pyridinyl)ethyl]butanamide;3,3-dimethyl-N-[2-(6-methyl-3-pyridinyl)ethyl]butanamide;3,3-dimethyl-N-(2-phenylethyl)butanamide;3,3-dimethyl-N-(2-pyridin-3-ylethyl)butanamide;N-[2-(3-methoxyphenyl)ethyl]-3,3-dimethylbutanamide;N-[2-(4-methoxyphenyl)ethyl]-3,3-dimethylbutanamide;N-[2-(2-methoxy-4-pyridinyl)ethyl]-3,3-dimethylbutanamide;N-[2-(6-methoxy-3-pyridinyl)ethyl]-3,3-dimethylbutanamide
CID 159050893
cis-(1S,2R)-2-cyclohexyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-cyclohexyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-(3-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropanecarboxamide
CID 159275291
methane;1-[2-methoxy-4-[6-(4-methoxy-2-phenylbutyl)pyrazin-2-yl]phenyl]pentan-2-one;1-[2-methoxy-4-[6-[(2R)-3-methoxy-2-phenylpropyl]pyrazin-2-yl]phenyl]pentan-2-one;1-[2-methoxy-4-[5-methyl-6-(2-phenylpentyl)pyrazin-2-yl]phenyl]pentan-2-one;1-[2-methoxy-4-[6-[(2R)-2-phenylpropyl]pyrazin-2-yl]phenyl]pentan-2-one;2-[2-methoxy-4-[6-[(2R)-2-pyridin-2-ylpentyl]pyrazin-2-yl]phenyl]-N-methylacetamide
CID 159286958
(3S)-4-[6-(2-fluorophenyl)-3-pyridinyl]-3-(methylamino)butan-2-one;(3S)-4-[6-(2-methoxyphenyl)-3-pyridinyl]-3-(methylamino)butan-2-one;(3S)-4-[6-(3-methoxyphenyl)-3-pyridinyl]-3-(methylamino)butan-2-one;(3S)-3-(methylamino)-4-[6-(2-propan-2-ylphenyl)-3-pyridinyl]butan-2-one
CID 160454697
2-methoxy-4-methyl-3-(1-methylpiperidin-4-yl)pyridine;2-methoxy-5-methyl-3-(1-methylpiperidin-4-yl)pyridine;2-methoxy-6-(1-methylpiperidin-4-yl)pyridine;3-methyl-2-(1-methylpiperidin-4-yl)cyclohexa-2,4-dien-1-one;4-methyl-2-(1-methylpiperidin-4-yl)cyclohexa-2,4-dien-1-one;3-methyl-2-(1-methylpiperidin-4-yl)cyclohexan-1-one;4-methyl-2-(1-methylpiperidin-4-yl)cyclohexan-1-one;2-(1-methylpiperidin-4-yl)cyclohexan-1-one;4-(1-methylpiperidin-4-yl)-1H-pyridin-2-one
CID 160480148
(3S)-4-[6-(2-fluorophenyl)-3-pyridinyl]-3-(methylamino)butan-2-one;(3S)-4-[6-(2-methoxyphenyl)-3-pyridinyl]-3-(methylamino)butan-2-one;(3S)-4-[6-(3-methoxyphenyl)-3-pyridinyl]-3-(methylamino)butan-2-one;(3S)-3-(methylamino)-4-[6-(3-methylphenyl)-3-pyridinyl]butan-2-one;(3S)-3-(methylamino)-4-[6-(2-propan-2-ylphenyl)-3-pyridinyl]butan-2-one
CID 161114966
(1R)-2-(3-fluorophenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide
CID 161387378
(3S)-1-(2-methoxy-5-pyridin-4-yl-3-pyridinyl)-4-phenyl-3-[(1-pyridin-2-ylcyclopropyl)amino]butan-2-one;3-[(3S)-2-oxo-4-phenyl-3-[(1-pyridin-2-ylcyclopropyl)amino]butyl]-5-pyridin-4-yl-1H-pyridin-2-one
CID 161631169

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide?
The IUPAC name of cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide (CID 159133736) is cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide.
What is the SMILES notation for cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide?
The canonical SMILES for cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide is CC.CC(C)(C)C(=O)[C@@H](NC(=O)C1CC1c1ccccn1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)C1C[C@@H]1c1ccccn1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)C1C[C@@H]1c1cccnc1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)[C@@H]1CC1c1ccccn1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)[C@@H]1CC1c1cccnc1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)[C@@H]1C[C@@H]1c1ccccc1)C(C)(C)C.CC(C)(C)C(=O)[C@@H](NC(=O)[C@@H]1C[C@@H]1c1ccccn1)C(C)(C)C.COc1ccccc1C1C[C@H]1C(=O)N[C@H](C(=O)C(C)(C)C)C(C)(C)C.
What is the InChIKey of cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide?
The InChIKey is KHFIUZCZJQFJMD-IIFWPAHNSA-N. The full InChI is InChI=1S/C21H31NO3.C20H29NO2.6C19H28N2O2.C2H6/c1-20(2,3)17(18(23)21(4,5)6)22-19(24)15-12-14(15)13-10-8-9-11-16(13)25-7;1-19(2,3)16(17(22)20(4,5)6)21-18(23)15-12-14(15)13-10-8-7-9-11-13;2*1-18(2,3)15(16(22)19(4,5)6)21-17(23)14-10-13(14)12-8-7-9-20-11-12;4*1-18(2,3)15(16(22)19(4,5)6)21-17(23)13-11-12(13)14-9-7-8-10-20-14;1-2/h8-11,14-15,17H,12H2,1-7H3,(H,22,24);7-11,14-16H,12H2,1-6H3,(H,21,23);2*7-9,11,13-15H,10H2,1-6H3,(H,21,23);4*7-10,12-13,15H,11H2,1-6H3,(H,21,23);1-2H3/t14?,15-,17-;14-,15-,16-;13?,14-,15-;13-,14?,15-;12?,13?,15-;12?,13-,15-;12-,13?,15+;12-,13+,15+;/m11111100./s1.
What are the key properties of cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide?
cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide has a molecular weight of 2589.68 g/mol, XLogP of 28.89, 33 rotatable bonds, 8 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-phenyl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;cis-(1R,2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;ethane;(1R)-2-(2-methoxyphenyl)-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(1R)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;2-pyridin-2-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide;(2S)-2-pyridin-3-yl-N-[(3S)-2,2,5,5-tetramethyl-4-oxohexan-3-yl]cyclopropane-1-carboxamide is sourced from PubChem (CID 159133736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).