N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide

C21H27N3O — CID 133276967

IUPACN-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide
SMILESO=C(NC1CCN(c2ccc3ccccc3n2)CC1)C1CCCCC1
InChIInChI=1S/C21H27N3O/c25-21(17-7-2-1-3-8-17)22-18-12-14-24(15-13-18)20-11-10-16-6-4-5-9-19(16)23-20/h4-6,9-11,17-18H,1-3,7-8,12-15H2,(H,22,25)
InChIKeyAFCDKRNXODTKHW-UHFFFAOYSA-N
MW337.47 g/mol
LogP3.90
Rot. Bonds3

About N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide

N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide (PubChem CID 133276967) has the molecular formula C21H27N3O and a molecular weight of 337.47 g/mol. Its IUPAC name is N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide
PubChem CID133276967
Molecular FormulaC21H27N3O
Molecular Weight337.47 g/mol
Exact Mass337.22
IUPAC NameN-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide
SMILESO=C(NC1CCN(c2ccc3ccccc3n2)CC1)C1CCCCC1
InChIInChI=1S/C21H27N3O/c25-21(17-7-2-1-3-8-17)22-18-12-14-24(15-13-18)20-11-10-16-6-4-5-9-19(16)23-20/h4-6,9-11,17-18H,1-3,7-8,12-15H2,(H,22,25)
InChIKeyAFCDKRNXODTKHW-UHFFFAOYSA-N
XLogP3.90
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.47
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide 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

N-[1-(2-methylpyrimidin-4-yl)piperidin-4-yl]cyclohexanecarboxamide
CID 146126539
cyclobutyl-(4-quinolin-2-ylpiperazin-1-yl)methanone
CID 171691592
N-[1-(1-methylbenzimidazol-2-yl)piperidin-4-yl]cyclobutanecarboxamide
CID 165434989
N-[1-(6-cyano-2-pyridinyl)piperidin-4-yl]cyclobutanecarboxamide
CID 163357560
6-[4-(cyclopropanecarbonylamino)piperidin-1-yl]pyridine-2-carboxylic acid
CID 122051588
N-cyclohexyl-1-(6-phenylpyridazin-3-yl)piperidine-4-carboxamide
CID 30360643
1-(7-bromoquinolin-2-yl)-N-(oxan-4-yl)piperidine-4-carboxamide
CID 171995055
pyrrolidin-1-yl-[1-(1-quinolin-2-ylpiperidin-4-yl)piperidin-3-yl]methanone
CID 56868951
ethyl 2-[(1-quinolin-2-ylpiperidine-4-carbonyl)amino]acetate
CID 122142945
N-(cyclopropylmethyl)-1-quinolin-2-ylpiperidin-4-amine
CID 115307554
N-quinolin-2-ylcyclopentanecarboxamide
CID 39959364
(3S)-N-cyclopropyl-1-(1-quinoxalin-2-ylpiperidin-4-yl)piperidine-3-carboxamide
CID 95550020

Frequently Asked Questions

What is the IUPAC name of N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide?
The IUPAC name of N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide (CID 133276967) is N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide.
What is the SMILES notation for N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide?
The canonical SMILES for N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide is O=C(NC1CCN(c2ccc3ccccc3n2)CC1)C1CCCCC1.
What is the InChIKey of N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide?
The InChIKey is AFCDKRNXODTKHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O/c25-21(17-7-2-1-3-8-17)22-18-12-14-24(15-13-18)20-11-10-16-6-4-5-9-19(16)23-20/h4-6,9-11,17-18H,1-3,7-8,12-15H2,(H,22,25).
What are the key properties of N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide?
N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide has a molecular weight of 337.47 g/mol, XLogP of 3.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-quinolin-2-ylpiperidin-4-yl)cyclohexanecarboxamide is sourced from PubChem (CID 133276967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).