N-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide

C24H32N4O — CID 92636232

IUPACN-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide
SMILESO=C(NCCC1CCCC1)c1ccc([C@@H]2CCCN(Cc3ccccn3)C2)nc1
InChIInChI=1S/C24H32N4O/c29-24(26-14-12-19-6-1-2-7-19)20-10-11-23(27-16-20)21-8-5-15-28(17-21)18-22-9-3-4-13-25-22/h3-4,9-11,13,16,19,21H,1-2,5-8,12,14-15,17-18H2,(H,26,29)/t21-/m1/s1
InChIKeyWDHFUOBKQUVOGC-OAQYLSRUSA-N
MW392.55 g/mol
LogP4.17
Rot. Bonds7

About N-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide

N-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide (PubChem CID 92636232) has the molecular formula C24H32N4O and a molecular weight of 392.55 g/mol. Its IUPAC name is N-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide
PubChem CID92636232
Molecular FormulaC24H32N4O
Molecular Weight392.55 g/mol
Exact Mass392.26
IUPAC NameN-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide
SMILESO=C(NCCC1CCCC1)c1ccc([C@@H]2CCCN(Cc3ccccn3)C2)nc1
InChIInChI=1S/C24H32N4O/c29-24(26-14-12-19-6-1-2-7-19)20-10-11-23(27-16-20)21-8-5-15-28(17-21)18-22-9-3-4-13-25-22/h3-4,9-11,13,16,19,21H,1-2,5-8,12,14-15,17-18H2,(H,26,29)/t21-/m1/s1
InChIKeyWDHFUOBKQUVOGC-OAQYLSRUSA-N
XLogP4.17
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.55
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2-methylphenoxy)ethyl]-6-[1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide
CID 110264343
N-[[2-(methoxymethyl)phenyl]methyl]-6-[(3S)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide
CID 92622012
N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide
CID 92621934
(4-ethoxypiperidin-1-yl)-[6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]-3-pyridinyl]methanone
CID 92621942
N-(cyclohexylmethyl)-3-[(3S)-1-(pyridin-2-ylmethyl)piperidin-3-yl]-1,2-oxazole-5-carboxamide
CID 92577417
6-[(3S)-1-(pyridin-2-ylmethyl)piperidin-3-yl]-1H-pyrazolo[5,4-b]pyridine
CID 125001236
N-[2-(3-hydroxypiperidin-1-yl)ethyl]-4-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxybenzamide
CID 45231108
[1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol;hydrochloride
CID 167311617
2-[[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]methyl]pyridine
CID 95844895
2-oxo-N-[[(3S)-1-(pyridin-2-ylmethyl)piperidin-3-yl]methyl]butanamide
CID 95227434
1-benzyl-3-[[(3S)-1-(pyridin-2-ylmethyl)piperidin-3-yl]methyl]urea
CID 95201612
N-[1-(pyridin-2-ylmethyl)piperidin-3-yl]furan-3-carboxamide
CID 45180386

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide?
The IUPAC name of N-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide (CID 92636232) is N-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide?
The canonical SMILES for N-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide is O=C(NCCC1CCCC1)c1ccc([C@@H]2CCCN(Cc3ccccn3)C2)nc1.
What is the InChIKey of N-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide?
The InChIKey is WDHFUOBKQUVOGC-OAQYLSRUSA-N. The full InChI is InChI=1S/C24H32N4O/c29-24(26-14-12-19-6-1-2-7-19)20-10-11-23(27-16-20)21-8-5-15-28(17-21)18-22-9-3-4-13-25-22/h3-4,9-11,13,16,19,21H,1-2,5-8,12,14-15,17-18H2,(H,26,29)/t21-/m1/s1.
What are the key properties of N-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide?
N-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide has a molecular weight of 392.55 g/mol, XLogP of 4.17, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylethyl)-6-[(3R)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine-3-carboxamide is sourced from PubChem (CID 92636232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).