N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide

C13H22N2O — CID 106313541

IUPACN-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCC1=CCCN(C(=O)NC2CCCCC2)C1
InChIInChI=1S/C13H22N2O/c1-11-6-5-9-15(10-11)13(16)14-12-7-3-2-4-8-12/h6,12H,2-5,7-10H2,1H3,(H,14,16)
InChIKeyIQXOSECWBMSWEL-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.68
Rot. Bonds1

About N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide

N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide (PubChem CID 106313541) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide
PubChem CID106313541
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC NameN-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide
SMILESCC1=CCCN(C(=O)NC2CCCCC2)C1
InChIInChI=1S/C13H22N2O/c1-11-6-5-9-15(10-11)13(16)14-12-7-3-2-4-8-12/h6,12H,2-5,7-10H2,1H3,(H,14,16)
InChIKeyIQXOSECWBMSWEL-UHFFFAOYSA-N
XLogP2.68
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-[(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 114172541
N-cycloheptylpiperidine-1-carboxamide
CID 54054704
(3R)-N-cyclohexyl-3-methylpyrrolidine-1-carboxamide
CID 66581198
N-cyclopentyl-3-oxopyrrolidine-1-carboxamide
CID 130826752
N-cycloheptyl-3-oxopiperazine-1-carboxamide
CID 119103460
(3S,5S)-N-cyclohexyl-3,5-dimethylpiperidine-1-carboxamide
CID 1332142
5-fluoro-N-[(3R)-oxan-3-yl]-3,6-dihydro-2H-pyridine-1-carboxamide
CID 126780814
N-cyclohexyl-4-phenylpiperazine-1-carboxamide
CID 858165
N-cyclohexyl-3-methyl-4-oxopiperidine-1-carboxamide
CID 114500022
(5-methyl-3,6-dihydro-2H-pyridin-1-yl)-pyrrolidin-1-ylmethanone
CID 106313552
4-tert-butyl-N-cyclopentyl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 115774573
4-acetamido-N-cyclopentylpiperidine-1-carboxamide
CID 49468459

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The IUPAC name of N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide (CID 106313541) is N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide is CC1=CCCN(C(=O)NC2CCCCC2)C1.
What is the InChIKey of N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide?
The InChIKey is IQXOSECWBMSWEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-11-6-5-9-15(10-11)13(16)14-12-7-3-2-4-8-12/h6,12H,2-5,7-10H2,1H3,(H,14,16).
What are the key properties of N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide?
N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide has a molecular weight of 222.33 g/mol, XLogP of 2.68, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide is sourced from PubChem (CID 106313541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).