N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide

C20H28N2O2 — CID 51096408

IUPACN-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide
SMILESCc1ccccc1C(=O)N1CCC(NC(=O)C2CCCCC2)CC1
InChIInChI=1S/C20H28N2O2/c1-15-7-5-6-10-18(15)20(24)22-13-11-17(12-14-22)21-19(23)16-8-3-2-4-9-16/h5-7,10,16-17H,2-4,8-9,11-14H2,1H3,(H,21,23)
InChIKeyXPBJJWIDEOVBTF-UHFFFAOYSA-N
MW328.46 g/mol
LogP3.30
Rot. Bonds3

About N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide

N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide (PubChem CID 51096408) has the molecular formula C20H28N2O2 and a molecular weight of 328.46 g/mol. Its IUPAC name is N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide
PubChem CID51096408
Molecular FormulaC20H28N2O2
Molecular Weight328.46 g/mol
Exact Mass328.22
IUPAC NameN-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide
SMILESCc1ccccc1C(=O)N1CCC(NC(=O)C2CCCCC2)CC1
InChIInChI=1S/C20H28N2O2/c1-15-7-5-6-10-18(15)20(24)22-13-11-17(12-14-22)21-19(23)16-8-3-2-4-9-16/h5-7,10,16-17H,2-4,8-9,11-14H2,1H3,(H,21,23)
InChIKeyXPBJJWIDEOVBTF-UHFFFAOYSA-N
XLogP3.30
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.46
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclobutanecarboxamide
CID 110820253
N-[1-(2-fluorobenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 110820345
N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 110820511
1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide
CID 1072829
1,1-dimethyl-3-[1-(2-methylbenzoyl)piperidin-4-yl]urea
CID 108566970
1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide
CID 1072799
N-cycloheptyl-1-[2-(2-methylphenyl)pyridine-3-carbonyl]piperidine-4-carboxamide
CID 46390267
N-(1-benzoylpiperidin-4-yl)cyclopentanecarboxamide
CID 110820191
2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]benzoic acid
CID 113083284
N-cycloheptyl-1-(2-fluorobenzoyl)piperidine-4-carboxamide
CID 17019024
azepan-1-yl-(2-methylphenyl)methanone
CID 4616576
N-cyclopentyl-4-(2-methylbenzoyl)-1,4-diazepane-1-carboxamide
CID 110811448

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide?
The IUPAC name of N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide (CID 51096408) is N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide is Cc1ccccc1C(=O)N1CCC(NC(=O)C2CCCCC2)CC1.
What is the InChIKey of N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide?
The InChIKey is XPBJJWIDEOVBTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O2/c1-15-7-5-6-10-18(15)20(24)22-13-11-17(12-14-22)21-19(23)16-8-3-2-4-9-16/h5-7,10,16-17H,2-4,8-9,11-14H2,1H3,(H,21,23).
What are the key properties of N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide?
N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide has a molecular weight of 328.46 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide is sourced from PubChem (CID 51096408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).