N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide

C20H31N3O — CID 118785980

IUPACN-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide
SMILESCc1cc(C(=O)NCCC2CCN(C3CCCC3)CC2)cc(C)n1
InChIInChI=1S/C20H31N3O/c1-15-13-18(14-16(2)22-15)20(24)21-10-7-17-8-11-23(12-9-17)19-5-3-4-6-19/h13-14,17,19H,3-12H2,1-2H3,(H,21,24)
InChIKeyRANAXQGWFJGGAY-UHFFFAOYSA-N
MW329.49 g/mol
LogP3.47
Rot. Bonds5

About N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide

N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide (PubChem CID 118785980) has the molecular formula C20H31N3O and a molecular weight of 329.49 g/mol. Its IUPAC name is N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide
PubChem CID118785980
Molecular FormulaC20H31N3O
Molecular Weight329.49 g/mol
Exact Mass329.25
IUPAC NameN-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide
SMILESCc1cc(C(=O)NCCC2CCN(C3CCCC3)CC2)cc(C)n1
InChIInChI=1S/C20H31N3O/c1-15-13-18(14-16(2)22-15)20(24)21-10-7-17-8-11-23(12-9-17)19-5-3-4-6-19/h13-14,17,19H,3-12H2,1-2H3,(H,21,24)
InChIKeyRANAXQGWFJGGAY-UHFFFAOYSA-N
XLogP3.47
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.49
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-(2-cyclohexylethyl)-6-methylpyridine-4-carboxamide
CID 113378333
N-(3-cyclopentyloxypropyl)-2,6-dimethylpyridine-4-carboxamide
CID 77084205
3,4,5-trifluoro-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
CID 115610737
2,6-dimethyl-N-[4-(oxolan-2-yl)butyl]pyridine-4-carboxamide
CID 131899729
2-chloro-6-methyl-N-[2-(oxan-2-yl)ethyl]pyridine-4-carboxamide
CID 104952816
N-[2-[1-[2-[(2,6-dimethyl-4-pyridinyl)carbamoylamino]ethyl]piperidin-4-yl]ethyl]-4-fluorobenzamide
CID 90920265
3,5-diamino-N-(2-cyclohexylethyl)benzamide
CID 61103497
N-(2-cyclopentylethyl)-3-hydroxy-4-methylbenzamide
CID 54932367
2-amino-6-chloro-N-(2-cyclopentylethyl)pyridine-4-carboxamide
CID 55041983
N-(2-cyclopentylethyl)-4-(ethylamino)-3,5-difluorobenzamide
CID 63185372
2,6-dimethyl-N-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine-4-carboxamide
CID 77085424
N-(2-cyclopentylethyl)-4-fluoro-3-methylbenzamide
CID 63212188

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide?
The IUPAC name of N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide (CID 118785980) is N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide.
What is the SMILES notation for N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide?
The canonical SMILES for N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide is Cc1cc(C(=O)NCCC2CCN(C3CCCC3)CC2)cc(C)n1.
What is the InChIKey of N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide?
The InChIKey is RANAXQGWFJGGAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N3O/c1-15-13-18(14-16(2)22-15)20(24)21-10-7-17-8-11-23(12-9-17)19-5-3-4-6-19/h13-14,17,19H,3-12H2,1-2H3,(H,21,24).
What are the key properties of N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide?
N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide has a molecular weight of 329.49 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-cyclopentylpiperidin-4-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide is sourced from PubChem (CID 118785980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).