(3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide

C14H20N2O — CID 144903948

IUPAC(3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide
SMILESC[C@@H]1CCCC(C(=O)N(C)c2ccccn2)C1
InChIInChI=1S/C14H20N2O/c1-11-6-5-7-12(10-11)14(17)16(2)13-8-3-4-9-15-13/h3-4,8-9,11-12H,5-7,10H2,1-2H3/t11-,12?/m1/s1
InChIKeyDWNIRZKDOKADLO-JHJMLUEUSA-N
MW232.33 g/mol
LogP2.87
Rot. Bonds2

About (3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide

(3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide (PubChem CID 144903948) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is (3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name(3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide
PubChem CID144903948
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name(3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide
SMILESC[C@@H]1CCCC(C(=O)N(C)c2ccccn2)C1
InChIInChI=1S/C14H20N2O/c1-11-6-5-7-12(10-11)14(17)16(2)13-8-3-4-9-15-13/h3-4,8-9,11-12H,5-7,10H2,1-2H3/t11-,12?/m1/s1
InChIKeyDWNIRZKDOKADLO-JHJMLUEUSA-N
XLogP2.87
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-hydroxy-N-methyl-N-pyridin-2-ylcyclohexane-1-carboxamide
CID 115150798
N-methyl-4-oxo-N-pyridin-2-ylcyclohexane-1-carboxamide
CID 115150404
4-ethyl-2-[methyl(pyridin-2-yl)carbamoyl]cyclopentane-1-carboxylic acid
CID 114511259
N-methyl-N-pyridin-2-ylpyrrolidine-1-carboxamide
CID 116653994
(1S)-3-methyl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide
CID 178156221
3-methyl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide;propane
CID 144736514
3-(cyclopropylamino)-N-methyl-N-pyridin-2-ylpropanamide
CID 60843331
[(3S)-3-methylcyclohexyl]-phenylmethanone
CID 134867416
2-N,6-N-dimethyl-2-N,6-N-dipyridin-2-ylpyridine-2,6-dicarboxamide
CID 101347293
2-(cyclohexylmethylamino)-N-methyl-N-pyridin-2-ylacetamide
CID 101057675
N-benzyl-N-(2-hydroxyethyl)-3-methylcyclohexane-1-carboxamide
CID 111477096
2-[methyl(pyridin-2-yl)sulfamoyl]cyclopentane-1-carboxylic acid
CID 103342275

Frequently Asked Questions

What is the IUPAC name of (3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide?
The IUPAC name of (3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide (CID 144903948) is (3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide.
What is the SMILES notation for (3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide?
The canonical SMILES for (3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide is C[C@@H]1CCCC(C(=O)N(C)c2ccccn2)C1.
What is the InChIKey of (3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide?
The InChIKey is DWNIRZKDOKADLO-JHJMLUEUSA-N. The full InChI is InChI=1S/C14H20N2O/c1-11-6-5-7-12(10-11)14(17)16(2)13-8-3-4-9-15-13/h3-4,8-9,11-12H,5-7,10H2,1-2H3/t11-,12?/m1/s1.
What are the key properties of (3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide?
(3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide has a molecular weight of 232.33 g/mol, XLogP of 2.87, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N,3-dimethyl-N-pyridin-2-ylcyclohexane-1-carboxamide is sourced from PubChem (CID 144903948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).