N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide

C20H28N2O2 — CID 4939416

IUPACN-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide
SMILESCC1CCN(C(=O)c2ccccc2NC(=O)C2CCCCC2)CC1
InChIInChI=1S/C20H28N2O2/c1-15-11-13-22(14-12-15)20(24)17-9-5-6-10-18(17)21-19(23)16-7-3-2-4-8-16/h5-6,9-10,15-16H,2-4,7-8,11-14H2,1H3,(H,21,23)
InChIKeyZMEGKWSHMNRLJQ-UHFFFAOYSA-N
MW328.46 g/mol
LogP4.08
Rot. Bonds3

About N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide

N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide (PubChem CID 4939416) has the molecular formula C20H28N2O2 and a molecular weight of 328.46 g/mol. Its IUPAC name is N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide
PubChem CID4939416
Molecular FormulaC20H28N2O2
Molecular Weight328.46 g/mol
Exact Mass328.22
IUPAC NameN-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide
SMILESCC1CCN(C(=O)c2ccccc2NC(=O)C2CCCCC2)CC1
InChIInChI=1S/C20H28N2O2/c1-15-11-13-22(14-12-15)20(24)17-9-5-6-10-18(17)21-19(23)16-7-3-2-4-8-16/h5-6,9-10,15-16H,2-4,7-8,11-14H2,1H3,(H,21,23)
InChIKeyZMEGKWSHMNRLJQ-UHFFFAOYSA-N
XLogP4.08
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 ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-methylpiperazine-1-carbonyl)phenyl]cyclohexanecarboxamide
CID 4943642
3-amino-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexane-1-carboxamide
CID 119711788
1-methyl-N-[2-(piperidine-1-carbonyl)phenyl]piperidine-4-carboxamide
CID 99817673
N-[2-(azepane-1-carbonyl)phenyl]-1-methylpiperidine-4-carboxamide
CID 99970642
N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]cyclohexanecarboxamide
CID 2988050
[2-(4-methylpiperidine-1-carbonyl)phenyl]thiourea
CID 169356775
1-methylsulfonyl-N-[2-(piperidine-1-carbonyl)phenyl]piperidine-4-carboxamide
CID 43040978
2-(cycloheptanecarbonylamino)benzoic acid
CID 55091870
2-[2-(4-methylpiperidine-1-carbonyl)anilino]ethene-1,1,2-tricarbonitrile
CID 168607156
3-cyclohexyl-N-[[2-(4-methylpiperidine-1-carbonyl)phenyl]carbamothioyl]propanamide
CID 4934492
(3S)-1-methylsulfonyl-N-[2-(piperidine-1-carbonyl)phenyl]piperidine-3-carboxamide
CID 33170416
1-(2-chlorobenzoyl)-N-[2-(cyclohexylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 17223536

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide (CID 4939416) is N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide is CC1CCN(C(=O)c2ccccc2NC(=O)C2CCCCC2)CC1.
What is the InChIKey of N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide?
The InChIKey is ZMEGKWSHMNRLJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O2/c1-15-11-13-22(14-12-15)20(24)17-9-5-6-10-18(17)21-19(23)16-7-3-2-4-8-16/h5-6,9-10,15-16H,2-4,7-8,11-14H2,1H3,(H,21,23).
What are the key properties of N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide?
N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide has a molecular weight of 328.46 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylpiperidine-1-carbonyl)phenyl]cyclohexanecarboxamide is sourced from PubChem (CID 4939416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).