2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine

C158H232N26O12 — CID 161215345

IUPAC2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine
SMILESCC(C)Cc1cccc(N2CCCC2)n1.CC(C)Cc1cccc(N2CCOC3(CCOC3)C2)n1.CC(C)Cc1cccc(N2CCOCC2)n1.CC(C)Cc1cccc(N2CCO[C@@]3(CCOC3)C2)n1.CC(C)Cc1cccc(N2CCO[C@]3(CCOC3)C2)n1.CC(C)Cc1cccc([C@H]2CCCCO2)n1.CC(C)Cc1cccc([C@H]2CCCOC2)n1.CC(C)Nc1cccc(N2CCC3(CCCO3)CC2)n1.CC(C)Nc1cccc2ocnc12.CC(C)Nc1cccn2ccnc12.CC(C)Nc1cccn2cnnc12.CC(C)Nc1cccnc1OC1CC1
InChIInChI=1S/C16H25N3O.3C16H24N2O2.2C14H21NO.C13H20N2O.C13H20N2.C11H16N2O.C10H13N3.C10H12N2O.C9H12N4/c1-13(2)17-14-5-3-6-15(18-14)19-10-8-16(9-11-19)7-4-12-20-16;3*1-13(2)10-14-4-3-5-15(17-14)18-7-9-20-16(11-18)6-8-19-12-16;1-11(2)9-13-6-3-7-14(15-13)12-5-4-8-16-10-12;1-11(2)10-12-6-5-7-13(15-12)14-8-3-4-9-16-14;1-11(2)10-12-4-3-5-13(14-12)15-6-8-16-9-7-15;1-11(2)10-12-6-5-7-13(14-12)15-8-3-4-9-15;1-8(2)13-10-4-3-7-12-11(10)14-9-5-6-9;1-8(2)12-9-4-3-6-13-7-5-11-10(9)13;1-7(2)12-8-4-3-5-9-10(8)11-6-13-9;1-7(2)11-8-4-3-5-13-6-10-12-9(8)13/h3,5-6,13H,4,7-12H2,1-2H3,(H,17,18);3*3-5,13H,6-12H2,1-2H3;3,6-7,11-12H,4-5,8-10H2,1-2H3;5-7,11,14H,3-4,8-10H2,1-2H3;3-5,11H,6-10H2,1-2H3;5-7,11H,3-4,8-10H2,1-2H3;3-4,7-9,13H,5-6H2,1-2H3;3-8,12H,1-2H3;3-7,12H,1-2H3;3-7,11H,1-2H3/t;2*16-;;12-;14-;;;;;;/m.10.01....../s1
InChIKeyUWUABGMBQUKTLH-DQUXPRNCSA-N
MW2687.76 g/mol
LogP30.37
Rot. Bonds34

About 2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine

2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine (PubChem CID 161215345) has the molecular formula C158H232N26O12 and a molecular weight of 2687.76 g/mol. Its IUPAC name is 2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine.

Molecular Properties

Compound Name2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine
PubChem CID161215345
Molecular FormulaC158H232N26O12
Molecular Weight2687.76 g/mol
Exact Mass2685.83
IUPAC Name2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine
SMILESCC(C)Cc1cccc(N2CCCC2)n1.CC(C)Cc1cccc(N2CCOC3(CCOC3)C2)n1.CC(C)Cc1cccc(N2CCOCC2)n1.CC(C)Cc1cccc(N2CCO[C@@]3(CCOC3)C2)n1.CC(C)Cc1cccc(N2CCO[C@]3(CCOC3)C2)n1.CC(C)Cc1cccc([C@H]2CCCCO2)n1.CC(C)Cc1cccc([C@H]2CCCOC2)n1.CC(C)Nc1cccc(N2CCC3(CCCO3)CC2)n1.CC(C)Nc1cccc2ocnc12.CC(C)Nc1cccn2ccnc12.CC(C)Nc1cccn2cnnc12.CC(C)Nc1cccnc1OC1CC1
InChIInChI=1S/C16H25N3O.3C16H24N2O2.2C14H21NO.C13H20N2O.C13H20N2.C11H16N2O.C10H13N3.C10H12N2O.C9H12N4/c1-13(2)17-14-5-3-6-15(18-14)19-10-8-16(9-11-19)7-4-12-20-16;3*1-13(2)10-14-4-3-5-15(17-14)18-7-9-20-16(11-18)6-8-19-12-16;1-11(2)9-13-6-3-7-14(15-13)12-5-4-8-16-10-12;1-11(2)10-12-6-5-7-13(15-12)14-8-3-4-9-16-14;1-11(2)10-12-4-3-5-13(14-12)15-6-8-16-9-7-15;1-11(2)10-12-6-5-7-13(14-12)15-8-3-4-9-15;1-8(2)13-10-4-3-7-12-11(10)14-9-5-6-9;1-8(2)12-9-4-3-6-13-7-5-11-10(9)13;1-7(2)12-8-4-3-5-9-10(8)11-6-13-9;1-7(2)11-8-4-3-5-13-6-10-12-9(8)13/h3,5-6,13H,4,7-12H2,1-2H3,(H,17,18);3*3-5,13H,6-12H2,1-2H3;3,6-7,11-12H,4-5,8-10H2,1-2H3;5-7,11,14H,3-4,8-10H2,1-2H3;3-5,11H,6-10H2,1-2H3;5-7,11H,3-4,8-10H2,1-2H3;3-4,7-9,13H,5-6H2,1-2H3;3-8,12H,1-2H3;3-7,12H,1-2H3;3-7,11H,1-2H3/t;2*16-;;12-;14-;;;;;;/m.10.01....../s1
InChIKeyUWUABGMBQUKTLH-DQUXPRNCSA-N
XLogP30.37
TPSA370.65 Ų
H-Bond Donors5
H-Bond Acceptors38
Rotatable Bonds34
Heavy Atoms196
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002687.76
LogP ≤ 530.37
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1038

Analyze 2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine with MolForge

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CID 161348184
N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-5-(5-isocyano-2-methylfuran-3-yl)-7-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-5-(5-isocyano-2-methylfuran-3-yl)-7-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-5-(3-isocyano-5-methylfuran-2-yl)-7-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-5-(5-isocyano-2-methylfuran-3-yl)-7-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-7-methyl-5-(2-methyl-1,3-oxazol-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-7-methyl-5-(1,2-oxazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-7-methyl-5-(1,2-oxazol-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
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N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-8-methyl-6-(1-methylbenzimidazol-5-yl)imidazo[1,2-b]pyridazine-3-carboxamide;N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-8-methyl-6-(1-methylbenzimidazol-5-yl)imidazo[1,2-b]pyridazine-3-carboxamide;bis(N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-8-methyl-6-(5-methyl-3-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide);bis(N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-8-methyl-6-(5-methyl-3-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide);6-(3-isocyano-5-methylfuran-2-yl)-8-methyl-N-[(2S)-1,1,1-trifluoropropan-2-yl]imidazo[1,2-b]pyridazine-3-carboxamide
CID 163699135
6-(1,3-benzoxazol-5-yl)-N-[(1S)-1-cyclopropyl-2,2,2-trifluoroethyl]-8-methylimidazo[1,2-b]pyridazine-3-carboxamide;6-(1,3-benzoxazol-5-yl)-N-[(1R)-1-cyclopropyl-2,2,2-trifluoroethyl]-8-methylimidazo[1,2-b]pyridazine-3-carboxamide;6-(1,3-benzoxazol-5-yl)-8-methyl-N-[(2R)-1,1,1-trifluoropropan-2-yl]imidazo[1,2-b]pyridazine-3-carboxamide;6-(1,3-benzoxazol-5-yl)-8-methyl-N-[(2S)-1,1,1-trifluoropropan-2-yl]imidazo[1,2-b]pyridazine-3-carboxamide;6-(3-cyanophenyl)-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-8-methylimidazo[1,2-b]pyridazine-3-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-6-(3,3-difluoropyrrolidin-1-yl)-8-methylimidazo[1,2-b]pyridazine-3-carboxamide;N-(1-cyclopropyl-2,2,2-trifluoroethyl)-6-(3-isocyanofuran-2-yl)-8-methylimidazo[1,2-b]pyridazine-3-carboxamide
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CID 157120482

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine?
The IUPAC name of 2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine (CID 161215345) is 2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine.
What is the SMILES notation for 2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine?
The canonical SMILES for 2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine is CC(C)Cc1cccc(N2CCCC2)n1.CC(C)Cc1cccc(N2CCOC3(CCOC3)C2)n1.CC(C)Cc1cccc(N2CCOCC2)n1.CC(C)Cc1cccc(N2CCO[C@@]3(CCOC3)C2)n1.CC(C)Cc1cccc(N2CCO[C@]3(CCOC3)C2)n1.CC(C)Cc1cccc([C@H]2CCCCO2)n1.CC(C)Cc1cccc([C@H]2CCCOC2)n1.CC(C)Nc1cccc(N2CCC3(CCCO3)CC2)n1.CC(C)Nc1cccc2ocnc12.CC(C)Nc1cccn2ccnc12.CC(C)Nc1cccn2cnnc12.CC(C)Nc1cccnc1OC1CC1.
What is the InChIKey of 2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine?
The InChIKey is UWUABGMBQUKTLH-DQUXPRNCSA-N. The full InChI is InChI=1S/C16H25N3O.3C16H24N2O2.2C14H21NO.C13H20N2O.C13H20N2.C11H16N2O.C10H13N3.C10H12N2O.C9H12N4/c1-13(2)17-14-5-3-6-15(18-14)19-10-8-16(9-11-19)7-4-12-20-16;3*1-13(2)10-14-4-3-5-15(17-14)18-7-9-20-16(11-18)6-8-19-12-16;1-11(2)9-13-6-3-7-14(15-13)12-5-4-8-16-10-12;1-11(2)10-12-6-5-7-13(15-12)14-8-3-4-9-16-14;1-11(2)10-12-4-3-5-13(14-12)15-6-8-16-9-7-15;1-11(2)10-12-6-5-7-13(14-12)15-8-3-4-9-15;1-8(2)13-10-4-3-7-12-11(10)14-9-5-6-9;1-8(2)12-9-4-3-6-13-7-5-11-10(9)13;1-7(2)12-8-4-3-5-9-10(8)11-6-13-9;1-7(2)11-8-4-3-5-13-6-10-12-9(8)13/h3,5-6,13H,4,7-12H2,1-2H3,(H,17,18);3*3-5,13H,6-12H2,1-2H3;3,6-7,11-12H,4-5,8-10H2,1-2H3;5-7,11,14H,3-4,8-10H2,1-2H3;3-5,11H,6-10H2,1-2H3;5-7,11H,3-4,8-10H2,1-2H3;3-4,7-9,13H,5-6H2,1-2H3;3-8,12H,1-2H3;3-7,12H,1-2H3;3-7,11H,1-2H3/t;2*16-;;12-;14-;;;;;;/m.10.01....../s1.
What are the key properties of 2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine?
2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine has a molecular weight of 2687.76 g/mol, XLogP of 30.37, 34 rotatable bonds, 5 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyloxy-N-propan-2-ylpyridin-3-amine;2-(2-methylpropyl)-6-[(2R)-oxan-2-yl]pyridine;2-(2-methylpropyl)-6-[(3R)-oxan-3-yl]pyridine;(5R)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;(5S)-9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;9-[6-(2-methylpropyl)-2-pyridinyl]-2,6-dioxa-9-azaspiro[4.5]decane;4-[6-(2-methylpropyl)-2-pyridinyl]morpholine;2-(2-methylpropyl)-6-pyrrolidin-1-ylpyridine;6-(1-oxa-8-azaspiro[4.5]decan-8-yl)-N-propan-2-ylpyridin-2-amine;N-propan-2-yl-1,3-benzoxazol-4-amine;N-propan-2-ylimidazo[1,2-a]pyridin-8-amine;N-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridin-8-amine is sourced from PubChem (CID 161215345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).