N-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide

C19H28N2O — CID 43918554

IUPACN-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide
SMILESCc1ccccc1CN1CCCC(C(=O)NC2CCCC2)C1
InChIInChI=1S/C19H28N2O/c1-15-7-2-3-8-16(15)13-21-12-6-9-17(14-21)19(22)20-18-10-4-5-11-18/h2-3,7-8,17-18H,4-6,9-14H2,1H3,(H,20,22)
InChIKeyAFYUYYYZACKFCL-UHFFFAOYSA-N
MW300.45 g/mol
LogP3.27
Rot. Bonds4

About N-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide

N-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide (PubChem CID 43918554) has the molecular formula C19H28N2O and a molecular weight of 300.45 g/mol. Its IUPAC name is N-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide
PubChem CID43918554
Molecular FormulaC19H28N2O
Molecular Weight300.45 g/mol
Exact Mass300.22
IUPAC NameN-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide
SMILESCc1ccccc1CN1CCCC(C(=O)NC2CCCC2)C1
InChIInChI=1S/C19H28N2O/c1-15-7-2-3-8-16(15)13-21-12-6-9-17(14-21)19(22)20-18-10-4-5-11-18/h2-3,7-8,17-18H,4-6,9-14H2,1H3,(H,20,22)
InChIKeyAFYUYYYZACKFCL-UHFFFAOYSA-N
XLogP3.27
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.45
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-chlorophenyl)methyl]-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide
CID 43924153
N-cyclohexyl-1-[(3-methylphenyl)methyl]piperidine-3-carboxamide
CID 43918586
N-[3-(dimethylamino)propyl]-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide
CID 43926238
N-[2-(tert-butylcarbamoyl)phenyl]-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide
CID 43925648
1-[(2-ethylphenyl)methyl]-N-methylpiperidine-3-carboxamide
CID 136534264
1-[(2-chlorophenyl)methyl]-N-cyclopropylpyrrolidine-3-carboxamide
CID 166602716
1-[(2-methylphenyl)methyl]-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-3-carboxamide
CID 43917314
(3R)-N-cyclohexyl-1-[(1-methylbenzimidazol-2-yl)methyl]piperidine-3-carboxamide
CID 124803554
N-cycloheptyl-1-[(2-hydroxyphenyl)methyl]piperidine-4-carboxamide
CID 30137317
[1-[(2-methylphenyl)methyl]piperidin-3-yl]-(4-phenylpiperazin-1-yl)methanone
CID 43920515
1-[(3-bromophenyl)methyl]-N-cyclooctylpiperidine-3-carboxamide
CID 43925877
1-[(2-chlorophenyl)methyl]-N-(2,3-dimethylphenyl)piperidine-3-carboxamide
CID 43920320

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide?
The IUPAC name of N-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide (CID 43918554) is N-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide is Cc1ccccc1CN1CCCC(C(=O)NC2CCCC2)C1.
What is the InChIKey of N-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide?
The InChIKey is AFYUYYYZACKFCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O/c1-15-7-2-3-8-16(15)13-21-12-6-9-17(14-21)19(22)20-18-10-4-5-11-18/h2-3,7-8,17-18H,4-6,9-14H2,1H3,(H,20,22).
What are the key properties of N-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide?
N-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide has a molecular weight of 300.45 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-[(2-methylphenyl)methyl]piperidine-3-carboxamide is sourced from PubChem (CID 43918554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).