N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide

C127H149F4N13O12 — CID 158148805

IUPACN-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide
SMILESCC(C)(C)CCNC(=O)c1ccc(COc2cccc(F)c2)nc1.C[C@@H](NC(=O)c1ccc(COc2cc(F)cc(F)c2)nc1)C1CCCCC1.C[C@@H](NC(=O)c1ccc(COc2ccc(F)cc2)nc1)C1CCCCC1.C[C@@H](NC(=O)c1ccc(COc2cccc(C#N)c2)nc1)C1CCCCC1.C[C@@H](NC(=O)c1ccc(COc2ccccc2)nc1)C1CCCCC1.O=C(NC1C2CC3CC(C2)CC1C3)c1ccc(COc2ccccc2)nc1
InChIInChI=1S/C23H26N2O2.C22H25N3O2.C21H24F2N2O2.C21H25FN2O2.C21H26N2O2.C19H23FN2O2/c26-23(25-22-18-9-15-8-16(11-18)12-19(22)10-15)17-6-7-20(24-13-17)14-27-21-4-2-1-3-5-21;1-16(18-7-3-2-4-8-18)25-22(26)19-10-11-20(24-14-19)15-27-21-9-5-6-17(12-21)13-23;1-14(15-5-3-2-4-6-15)25-21(26)16-7-8-19(24-12-16)13-27-20-10-17(22)9-18(23)11-20;1-15(16-5-3-2-4-6-16)24-21(25)17-7-10-19(23-13-17)14-26-20-11-8-18(22)9-12-20;1-16(17-8-4-2-5-9-17)23-21(24)18-12-13-19(22-14-18)15-25-20-10-6-3-7-11-20;1-19(2,3)9-10-21-18(23)14-7-8-16(22-12-14)13-24-17-6-4-5-15(20)11-17/h1-7,13,15-16,18-19,22H,8-12,14H2,(H,25,26);5-6,9-12,14,16,18H,2-4,7-8,15H2,1H3,(H,25,26);7-12,14-15H,2-6,13H2,1H3,(H,25,26);7-13,15-16H,2-6,14H2,1H3,(H,24,25);3,6-7,10-14,16-17H,2,4-5,8-9,15H2,1H3,(H,23,24);4-8,11-12H,9-10,13H2,1-3H3,(H,21,23)/t;16-;14-;15-;16-;/m.1111./s1
InChIKeyFUVNUJQNFHKBKR-BAHXGGQMSA-N
MW2125.66 g/mol
LogP25.91
Rot. Bonds35

About N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide

N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide (PubChem CID 158148805) has the molecular formula C127H149F4N13O12 and a molecular weight of 2125.66 g/mol. Its IUPAC name is N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide
PubChem CID158148805
Molecular FormulaC127H149F4N13O12
Molecular Weight2125.66 g/mol
Exact Mass2124.14
IUPAC NameN-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide
SMILESCC(C)(C)CCNC(=O)c1ccc(COc2cccc(F)c2)nc1.C[C@@H](NC(=O)c1ccc(COc2cc(F)cc(F)c2)nc1)C1CCCCC1.C[C@@H](NC(=O)c1ccc(COc2ccc(F)cc2)nc1)C1CCCCC1.C[C@@H](NC(=O)c1ccc(COc2cccc(C#N)c2)nc1)C1CCCCC1.C[C@@H](NC(=O)c1ccc(COc2ccccc2)nc1)C1CCCCC1.O=C(NC1C2CC3CC(C2)CC1C3)c1ccc(COc2ccccc2)nc1
InChIInChI=1S/C23H26N2O2.C22H25N3O2.C21H24F2N2O2.C21H25FN2O2.C21H26N2O2.C19H23FN2O2/c26-23(25-22-18-9-15-8-16(11-18)12-19(22)10-15)17-6-7-20(24-13-17)14-27-21-4-2-1-3-5-21;1-16(18-7-3-2-4-8-18)25-22(26)19-10-11-20(24-14-19)15-27-21-9-5-6-17(12-21)13-23;1-14(15-5-3-2-4-6-15)25-21(26)16-7-8-19(24-12-16)13-27-20-10-17(22)9-18(23)11-20;1-15(16-5-3-2-4-6-16)24-21(25)17-7-10-19(23-13-17)14-26-20-11-8-18(22)9-12-20;1-16(17-8-4-2-5-9-17)23-21(24)18-12-13-19(22-14-18)15-25-20-10-6-3-7-11-20;1-19(2,3)9-10-21-18(23)14-7-8-16(22-12-14)13-24-17-6-4-5-15(20)11-17/h1-7,13,15-16,18-19,22H,8-12,14H2,(H,25,26);5-6,9-12,14,16,18H,2-4,7-8,15H2,1H3,(H,25,26);7-12,14-15H,2-6,13H2,1H3,(H,25,26);7-13,15-16H,2-6,14H2,1H3,(H,24,25);3,6-7,10-14,16-17H,2,4-5,8-9,15H2,1H3,(H,23,24);4-8,11-12H,9-10,13H2,1-3H3,(H,21,23)/t;16-;14-;15-;16-;/m.1111./s1
InChIKeyFUVNUJQNFHKBKR-BAHXGGQMSA-N
XLogP25.91
TPSA331.11 Ų
H-Bond Donors6
H-Bond Acceptors19
Rotatable Bonds35
Heavy Atoms156
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002125.66
LogP ≤ 525.91
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1019

Analyze N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide with MolForge

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Related Compounds

6-[(3-cyano-5-fluorophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide
CID 58533710
6-[(3-cyano-5-fluorophenoxy)methyl]-N-[(1S)-1-cyclohexylethyl]pyridine-3-carboxamide
CID 58533772
N-[1-[4-[2-fluoro-4-[[5-[1-(oxan-4-yl)ethylcarbamoyl]-2-pyridinyl]methoxy]phenyl]cyclohexyl]ethyl]-6-(phenoxymethyl)pyridine-3-carboxamide
CID 123158735
N-[1-[4-[3-[[5-(cyclohexylcarbamoyl)-2-pyridinyl]methoxy]-5-fluorophenyl]cyclohexyl]ethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide
CID 123169123
N-[1-[4-[3-[[5-(1-cyclohexylethylcarbamoyl)-2-pyridinyl]methoxy]-5-fluorophenyl]cyclohexyl]ethyl]-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide
CID 123188590
N-[1-[4-[3-[[5-(1-cyclopropylethylcarbamoyl)-2-pyridinyl]methoxy]-5-fluorophenyl]cyclohexyl]ethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide
CID 123400736
N-[1-[3-[3-[[5-(1-cyclohexylethylcarbamoyl)-2-pyridinyl]methoxy]-5-fluorophenyl]cyclohexyl]ethyl]-6-[(2-fluorophenoxy)methyl]pyridine-3-carboxamide
CID 123454065
N-cyclohexyl-6-[[3-(trifluoromethyl)phenoxy]methyl]pyridine-2-carboxamide;[6-[[3-(1,1-difluoroethyl)phenoxy]methyl]-2-pyridinyl]-(3,5-dimethylpiperidin-1-yl)methanone;(3,3-dimethylpiperidin-1-yl)-[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]methanone;(2-ethylpiperidin-1-yl)-[6-[[3-(trifluoromethyl)phenoxy]methyl]-2-pyridinyl]methanone
CID 123491630
N-(1-cyclohexylethyl)-6-[[3-fluoro-4-[4-[1-[[6-[(2-fluorophenoxy)methyl]pyridine-3-carbonyl]amino]ethyl]cyclohexyl]phenoxy]methyl]pyridine-3-carboxamide
CID 123510852
N-[1-[4-[3-[[5-(cyclobutylcarbamoyl)-2-pyridinyl]methoxy]-5-fluorophenyl]cyclohexyl]ethyl]-6-[(2-methoxyphenoxy)methyl]pyridine-3-carboxamide
CID 123804402
N-[4-[3-[[5-(1-cyclopropylethylcarbamoyl)-2-pyridinyl]methoxy]-5-fluorophenyl]-3-methylbutyl]-6-(phenoxymethyl)pyridine-3-carboxamide
CID 123823668
N-[1-[3-[3-fluoro-5-[[5-[1-(oxan-4-yl)ethylcarbamoyl]-2-pyridinyl]methoxy]phenyl]cyclohexyl]ethyl]-6-(pyridin-4-yloxymethyl)pyridine-3-carboxamide
CID 124002267

Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide?
The IUPAC name of N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide (CID 158148805) is N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide.
What is the SMILES notation for N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide?
The canonical SMILES for N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide is CC(C)(C)CCNC(=O)c1ccc(COc2cccc(F)c2)nc1.C[C@@H](NC(=O)c1ccc(COc2cc(F)cc(F)c2)nc1)C1CCCCC1.C[C@@H](NC(=O)c1ccc(COc2ccc(F)cc2)nc1)C1CCCCC1.C[C@@H](NC(=O)c1ccc(COc2cccc(C#N)c2)nc1)C1CCCCC1.C[C@@H](NC(=O)c1ccc(COc2ccccc2)nc1)C1CCCCC1.O=C(NC1C2CC3CC(C2)CC1C3)c1ccc(COc2ccccc2)nc1.
What is the InChIKey of N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide?
The InChIKey is FUVNUJQNFHKBKR-BAHXGGQMSA-N. The full InChI is InChI=1S/C23H26N2O2.C22H25N3O2.C21H24F2N2O2.C21H25FN2O2.C21H26N2O2.C19H23FN2O2/c26-23(25-22-18-9-15-8-16(11-18)12-19(22)10-15)17-6-7-20(24-13-17)14-27-21-4-2-1-3-5-21;1-16(18-7-3-2-4-8-18)25-22(26)19-10-11-20(24-14-19)15-27-21-9-5-6-17(12-21)13-23;1-14(15-5-3-2-4-6-15)25-21(26)16-7-8-19(24-12-16)13-27-20-10-17(22)9-18(23)11-20;1-15(16-5-3-2-4-6-16)24-21(25)17-7-10-19(23-13-17)14-26-20-11-8-18(22)9-12-20;1-16(17-8-4-2-5-9-17)23-21(24)18-12-13-19(22-14-18)15-25-20-10-6-3-7-11-20;1-19(2,3)9-10-21-18(23)14-7-8-16(22-12-14)13-24-17-6-4-5-15(20)11-17/h1-7,13,15-16,18-19,22H,8-12,14H2,(H,25,26);5-6,9-12,14,16,18H,2-4,7-8,15H2,1H3,(H,25,26);7-12,14-15H,2-6,13H2,1H3,(H,25,26);7-13,15-16H,2-6,14H2,1H3,(H,24,25);3,6-7,10-14,16-17H,2,4-5,8-9,15H2,1H3,(H,23,24);4-8,11-12H,9-10,13H2,1-3H3,(H,21,23)/t;16-;14-;15-;16-;/m.1111./s1.
What are the key properties of N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide?
N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide has a molecular weight of 2125.66 g/mol, XLogP of 25.91, 35 rotatable bonds, 6 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)-6-(phenoxymethyl)pyridine-3-carboxamide;6-[(3-cyanophenoxy)methyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(3,5-difluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(4-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-(phenoxymethyl)pyridine-3-carboxamide;N-(3,3-dimethylbutyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 158148805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).