1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea

C15H20N2O — CID 108912377

IUPAC1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea
SMILESCc1ccccc1NC(=O)NC=C1CCCCC1
InChIInChI=1S/C15H20N2O/c1-12-7-5-6-10-14(12)17-15(18)16-11-13-8-3-2-4-9-13/h5-7,10-11H,2-4,8-9H2,1H3,(H2,16,17,18)
InChIKeyYIXLNNVJNGFDQF-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.96
Rot. Bonds2

About 1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea

1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea (PubChem CID 108912377) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea.

Molecular Properties

Compound Name1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea
PubChem CID108912377
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea
SMILESCc1ccccc1NC(=O)NC=C1CCCCC1
InChIInChI=1S/C15H20N2O/c1-12-7-5-6-10-14(12)17-15(18)16-11-13-8-3-2-4-9-13/h5-7,10-11H,2-4,8-9H2,1H3,(H2,16,17,18)
InChIKeyYIXLNNVJNGFDQF-UHFFFAOYSA-N
XLogP3.96
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(cyclohexylidenemethyl)-3-(2-propan-2-ylphenyl)urea
CID 108912386
1-(2-amino-4-methylphenyl)-3-(cyclohexylidenemethyl)urea
CID 108912676
1-(cyclohexylidenemethyl)-3-(2,3,4-trifluorophenyl)urea
CID 108912672
1-(cyclopentylidenemethyl)-3-(3-methylphenyl)urea
CID 108913541
1-(2-methylphenyl)-3-(2-piperidin-1-ylphenyl)urea
CID 2814230
1-(4-aminophenyl)-3-(cyclopentylidenemethyl)urea
CID 108913432
N-(2-methylphenyl)azepane-1-carboxamide
CID 19165583
1-[4-chloro-2-(trifluoromethyl)phenyl]-3-(cyclohexylidenemethyl)urea
CID 108912646
1-(2-methylphenyl)-3-[3-[(2-methylphenyl)carbamoylamino]phenyl]urea
CID 1110848
2-[4-(cyclohexylidenemethylcarbamoylamino)phenyl]acetic acid
CID 108912522
(2-methylphenyl)urea;phosphane
CID 175888509
1-(2-cyanophenyl)-3-(oxan-4-ylidenemethyl)urea
CID 108913082

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea?
The IUPAC name of 1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea (CID 108912377) is 1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea.
What is the SMILES notation for 1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea?
The canonical SMILES for 1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea is Cc1ccccc1NC(=O)NC=C1CCCCC1.
What is the InChIKey of 1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea?
The InChIKey is YIXLNNVJNGFDQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-12-7-5-6-10-14(12)17-15(18)16-11-13-8-3-2-4-9-13/h5-7,10-11H,2-4,8-9H2,1H3,(H2,16,17,18).
What are the key properties of 1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea?
1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea has a molecular weight of 244.34 g/mol, XLogP of 3.96, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylidenemethyl)-3-(2-methylphenyl)urea is sourced from PubChem (CID 108912377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).