4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide

C15H22N2O — CID 21082136

IUPAC4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide
SMILESCN(C)C1(c2ccccc2)CCC(C(N)=O)CC1
InChIInChI=1S/C15H22N2O/c1-17(2)15(13-6-4-3-5-7-13)10-8-12(9-11-15)14(16)18/h3-7,12H,8-11H2,1-2H3,(H2,16,18)
InChIKeyMAQSZSPMPOZEOT-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.12
Rot. Bonds3

About 4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide

4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide (PubChem CID 21082136) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide
PubChem CID21082136
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide
SMILESCN(C)C1(c2ccccc2)CCC(C(N)=O)CC1
InChIInChI=1S/C15H22N2O/c1-17(2)15(13-6-4-3-5-7-13)10-8-12(9-11-15)14(16)18/h3-7,12H,8-11H2,1-2H3,(H2,16,18)
InChIKeyMAQSZSPMPOZEOT-UHFFFAOYSA-N
XLogP2.12
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,1-N-dimethyl-1-phenylcyclohexane-1,4-diamine;hydrochloride
CID 68895646
1-amino-4-(dimethylamino)-4-phenylcyclohexane-1-carboxylic acid
CID 130202617
methyl 2-[4-(dimethylamino)-4-phenylcyclohexyl]acetate;hydrochloride
CID 67386483
4-butanimidoyl-N,N-dimethyl-1-phenylcyclohexan-1-amine
CID 174626457
1-(2-cyanophenyl)-1-[[4-(dimethylamino)-4-phenylcyclohexyl]methyl]urea
CID 155198488
4-(4-fluorophenyl)-4-methoxycyclohexane-1-carboxamide
CID 89478672
2-chloro-2-[4-(dimethylamino)-4-phenylcyclohexyl]-N-phenylacetamide;hydrate
CID 68614511
4-carbamoyl-4-phenylcyclohexane-1-carboxylic acid
CID 115046067
4-N-cyclooctyl-1-N,1-N-dimethyl-1-phenylcyclohexane-1,4-diamine;dihydrochloride
CID 69337826
2-[4-(dimethylamino)-4-phenylcyclohexyl]-N-(4-fluorophenyl)acetamide;2-[4-(dimethylamino)-4-phenylcyclohexyl]-N-phenylacetamide;trihydrochloride
CID 162048374
aniline;cyclobutanecarboxamide
CID 145209318
[8-(dimethylamino)-8-phenyl-2-azaspiro[4.5]decan-2-yl]-(oxan-4-yl)methanone
CID 118662447

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide?
The IUPAC name of 4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide (CID 21082136) is 4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide.
What is the SMILES notation for 4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide?
The canonical SMILES for 4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide is CN(C)C1(c2ccccc2)CCC(C(N)=O)CC1.
What is the InChIKey of 4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide?
The InChIKey is MAQSZSPMPOZEOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-17(2)15(13-6-4-3-5-7-13)10-8-12(9-11-15)14(16)18/h3-7,12H,8-11H2,1-2H3,(H2,16,18).
What are the key properties of 4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide?
4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide has a molecular weight of 246.35 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-4-phenylcyclohexane-1-carboxamide is sourced from PubChem (CID 21082136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).