1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea

C15H22N2O — CID 5051501

IUPAC1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea
SMILESCc1ccccc1NC(=O)N(C)C1CCCCC1
InChIInChI=1S/C15H22N2O/c1-12-8-6-7-11-14(12)16-15(18)17(2)13-9-4-3-5-10-13/h6-8,11,13H,3-5,9-10H2,1-2H3,(H,16,18)
InChIKeyMCAHCVYDLQQNEL-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.79
Rot. Bonds2

About 1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea

1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea (PubChem CID 5051501) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea.

Molecular Properties

Compound Name1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea
PubChem CID5051501
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea
SMILESCc1ccccc1NC(=O)N(C)C1CCCCC1
InChIInChI=1S/C15H22N2O/c1-12-8-6-7-11-14(12)16-15(18)17(2)13-9-4-3-5-10-13/h6-8,11,13H,3-5,9-10H2,1-2H3,(H,16,18)
InChIKeyMCAHCVYDLQQNEL-UHFFFAOYSA-N
XLogP3.79
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclohexyl-3-(2-iodophenyl)-1-methylurea
CID 108868896
3-(2-bromophenyl)-1-cyclohexyl-1-methylurea
CID 108868725
1-cyclohexyl-3-(2,4-dimethylphenyl)-1-methylurea
CID 4089734
2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide
CID 16577693
1-cycloheptyl-3-[2-(methoxymethyl)phenyl]-1-methylurea
CID 47034829
1-cyclohexyl-3-(4-methoxy-2-methylphenyl)-1-methylurea
CID 69479184
3-[[cyclopentyl(methyl)carbamoyl]amino]-4-methylbenzoic acid
CID 61194333
4-[[cyclopentyl(methyl)carbamoyl]amino]-3-methylbenzoic acid
CID 61194151
1-cyclohexyl-3-[2-fluoro-3-(trifluoromethyl)phenyl]-1-methylurea
CID 69478072
1-cyclohexyl-1-methyl-3-(1-methylindol-3-yl)urea
CID 16813050
2-[[cyclohexyl(methyl)carbamoyl]amino]-5-methylbenzoic acid
CID 45267881
S-[[cyclohexyl(methyl)carbamoyl]amino] 2-methylbenzenecarbothioate
CID 22306539

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea?
The IUPAC name of 1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea (CID 5051501) is 1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea.
What is the SMILES notation for 1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea?
The canonical SMILES for 1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea is Cc1ccccc1NC(=O)N(C)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea?
The InChIKey is MCAHCVYDLQQNEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12-8-6-7-11-14(12)16-15(18)17(2)13-9-4-3-5-10-13/h6-8,11,13H,3-5,9-10H2,1-2H3,(H,16,18).
What are the key properties of 1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea?
1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea has a molecular weight of 246.35 g/mol, XLogP of 3.79, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-methyl-3-(2-methylphenyl)urea is sourced from PubChem (CID 5051501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).