N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide

C19H26N2O2 — CID 110820278

IUPACN-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide
SMILESCc1cccc(C(=O)N2CCC(NC(=O)C3CCCC3)CC2)c1
InChIInChI=1S/C19H26N2O2/c1-14-5-4-8-16(13-14)19(23)21-11-9-17(10-12-21)20-18(22)15-6-2-3-7-15/h4-5,8,13,15,17H,2-3,6-7,9-12H2,1H3,(H,20,22)
InChIKeyJTIHERXALACHKJ-UHFFFAOYSA-N
MW314.43 g/mol
LogP2.91
Rot. Bonds3

About N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide

N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide (PubChem CID 110820278) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide
PubChem CID110820278
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC NameN-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide
SMILESCc1cccc(C(=O)N2CCC(NC(=O)C3CCCC3)CC2)c1
InChIInChI=1S/C19H26N2O2/c1-14-5-4-8-16(13-14)19(23)21-11-9-17(10-12-21)20-18(22)15-6-2-3-7-15/h4-5,8,13,15,17H,2-3,6-7,9-12H2,1H3,(H,20,22)
InChIKeyJTIHERXALACHKJ-UHFFFAOYSA-N
XLogP2.91
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-1-(3-methylbenzoyl)piperidine-3-carboxamide
CID 50803988
N-cyclopropyl-1-[1-(3-methylbenzoyl)piperidin-4-yl]piperidine-4-carboxamide
CID 42395399
N-(1-benzoylpiperidin-4-yl)cyclopentanecarboxamide
CID 110820191
N-[1-(3-chlorobenzoyl)piperidin-4-yl]cyclobutanecarboxamide
CID 110821021
[3-[4-(cyclopentanecarbonylamino)piperidine-1-carbonyl]phenyl] acetate
CID 108927512
N-[1-(4-methylbenzoyl)piperidin-4-yl]cyclobutanecarboxamide
CID 110820327
N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide
CID 108549986
2-chloro-N-[1-(3-methylbenzoyl)piperidin-4-yl]acetamide
CID 108566071
N-cyclopentyl-4-(3-methylbenzoyl)-1,4-diazepane-1-carboxamide
CID 38217781
4-tert-butyl-N-[1-(3-methylbenzoyl)piperidin-4-yl]benzamide
CID 108554160
azocan-1-yl-(3-methylphenyl)methanone
CID 3308040
N-[1-(3-methylbenzoyl)piperidin-4-yl]pyridine-2-carboxamide
CID 110820295

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide?
The IUPAC name of N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide (CID 110820278) is N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide is Cc1cccc(C(=O)N2CCC(NC(=O)C3CCCC3)CC2)c1.
What is the InChIKey of N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide?
The InChIKey is JTIHERXALACHKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2/c1-14-5-4-8-16(13-14)19(23)21-11-9-17(10-12-21)20-18(22)15-6-2-3-7-15/h4-5,8,13,15,17H,2-3,6-7,9-12H2,1H3,(H,20,22).
What are the key properties of N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide?
N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide has a molecular weight of 314.43 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide is sourced from PubChem (CID 110820278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).