(4-benzamido-4-methylcyclohexyl)carbamic acid

C15H20N2O3 — CID 156534206

IUPAC(4-benzamido-4-methylcyclohexyl)carbamic acid
SMILESCC1(NC(=O)c2ccccc2)CCC(NC(=O)O)CC1
InChIInChI=1S/C15H20N2O3/c1-15(9-7-12(8-10-15)16-14(19)20)17-13(18)11-5-3-2-4-6-11/h2-6,12,16H,7-10H2,1H3,(H,17,18)(H,19,20)
InChIKeyCFMWSBYGCHRINS-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.39
Rot. Bonds3

About (4-benzamido-4-methylcyclohexyl)carbamic acid

(4-benzamido-4-methylcyclohexyl)carbamic acid (PubChem CID 156534206) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is (4-benzamido-4-methylcyclohexyl)carbamic acid.

Molecular Properties

Compound Name(4-benzamido-4-methylcyclohexyl)carbamic acid
PubChem CID156534206
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name(4-benzamido-4-methylcyclohexyl)carbamic acid
SMILESCC1(NC(=O)c2ccccc2)CCC(NC(=O)O)CC1
InChIInChI=1S/C15H20N2O3/c1-15(9-7-12(8-10-15)16-14(19)20)17-13(18)11-5-3-2-4-6-11/h2-6,12,16H,7-10H2,1H3,(H,17,18)(H,19,20)
InChIKeyCFMWSBYGCHRINS-UHFFFAOYSA-N
XLogP2.39
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-tert-butyl-4-propan-2-ylcyclohexyl)benzamide
CID 122679834
N-cyclohexyl-5-methylcyclodeca-1,3,5,7,9-pentaene-1-carboxamide
CID 171081015
3-amino-N-(1,4-dimethylcyclohexyl)benzamide
CID 119765803
N-(cyclopropylcarbamothioyl)benzamide
CID 3620996
N-[4-(2-methylpropyl)cyclohexyl]benzamide
CID 165058594
N-[1-(cyclooctylamino)-1-oxopropan-2-yl]benzamide
CID 18158922
ethane;N-(1-methylpiperidin-4-yl)benzamide
CID 142009687
N-(4-methylsulfanylcyclohexyl)benzamide
CID 114124420
[(3S)-3-methyl-3-(phenylmethoxycarbonylamino)cyclohexyl]carbamic acid
CID 122514592
N-(2-benzamidocyclobutyl)benzamide
CID 58037122
N-[(3S)-5,5-dimethyloxolan-3-yl]benzamide
CID 11138618
1-(1-benzylpiperidin-4-yl)-3-(1-methylcyclobutyl)urea
CID 136517668

Frequently Asked Questions

What is the IUPAC name of (4-benzamido-4-methylcyclohexyl)carbamic acid?
The IUPAC name of (4-benzamido-4-methylcyclohexyl)carbamic acid (CID 156534206) is (4-benzamido-4-methylcyclohexyl)carbamic acid.
What is the SMILES notation for (4-benzamido-4-methylcyclohexyl)carbamic acid?
The canonical SMILES for (4-benzamido-4-methylcyclohexyl)carbamic acid is CC1(NC(=O)c2ccccc2)CCC(NC(=O)O)CC1.
What is the InChIKey of (4-benzamido-4-methylcyclohexyl)carbamic acid?
The InChIKey is CFMWSBYGCHRINS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-15(9-7-12(8-10-15)16-14(19)20)17-13(18)11-5-3-2-4-6-11/h2-6,12,16H,7-10H2,1H3,(H,17,18)(H,19,20).
What are the key properties of (4-benzamido-4-methylcyclohexyl)carbamic acid?
(4-benzamido-4-methylcyclohexyl)carbamic acid has a molecular weight of 276.34 g/mol, XLogP of 2.39, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-benzamido-4-methylcyclohexyl)carbamic acid is sourced from PubChem (CID 156534206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).