1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea

C16H24N2O — CID 86962509

IUPAC1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea
SMILESCc1ccc(CCNC(=O)NC2CCCC2C)cc1
InChIInChI=1S/C16H24N2O/c1-12-6-8-14(9-7-12)10-11-17-16(19)18-15-5-3-4-13(15)2/h6-9,13,15H,3-5,10-11H2,1-2H3,(H2,17,18,19)
InChIKeyRFJRUVNCXWZIFJ-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.03
Rot. Bonds4

About 1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea

1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea (PubChem CID 86962509) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea.

Molecular Properties

Compound Name1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea
PubChem CID86962509
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea
SMILESCc1ccc(CCNC(=O)NC2CCCC2C)cc1
InChIInChI=1S/C16H24N2O/c1-12-6-8-14(9-7-12)10-11-17-16(19)18-15-5-3-4-13(15)2/h6-9,13,15H,3-5,10-11H2,1-2H3,(H2,17,18,19)
InChIKeyRFJRUVNCXWZIFJ-UHFFFAOYSA-N
XLogP3.03
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(2-methylcyclohexyl)carbamoylamino]-N-(2-phenylethyl)acetamide
CID 134003762
N-[2-[[(1R,2R)-2-methylcyclopentyl]carbamoylamino]ethyl]-2-phenylacetamide
CID 95339721
2-[(4-methylphenyl)methylcarbamoylamino]cyclopentane-1-carboxylic acid
CID 64817088
1-(3-hydroxypropyl)-3-(2-methylcyclopentyl)urea
CID 111104441
1-[(4-chlorophenyl)methyl]-3-(2-methylcyclohexyl)urea
CID 47133576
1-methyl-3-[2-(4-methylphenyl)ethyl]urea
CID 18334314
1-(2-methylcycloheptyl)-3-propylurea
CID 115660989
ethyl 4-[2-(4-methylphenyl)ethylcarbamoylamino]piperidine-1-carboxylate
CID 108891194
1-(2-methoxyethyl)-3-(2-methylcyclohexyl)urea
CID 47133656
1-ethyl-3-(2-methylcyclohexyl)urea
CID 112682943
2-(3,4-dimethylphenyl)-N-(2-methylcyclohexyl)acetamide
CID 18157580
1-[(4-ethoxyphenyl)methyl]-3-(2-methylcyclohexyl)urea
CID 108884452

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea?
The IUPAC name of 1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea (CID 86962509) is 1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea.
What is the SMILES notation for 1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea?
The canonical SMILES for 1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea is Cc1ccc(CCNC(=O)NC2CCCC2C)cc1.
What is the InChIKey of 1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea?
The InChIKey is RFJRUVNCXWZIFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-12-6-8-14(9-7-12)10-11-17-16(19)18-15-5-3-4-13(15)2/h6-9,13,15H,3-5,10-11H2,1-2H3,(H2,17,18,19).
What are the key properties of 1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea?
1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea has a molecular weight of 260.38 g/mol, XLogP of 3.03, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclopentyl)-3-[2-(4-methylphenyl)ethyl]urea is sourced from PubChem (CID 86962509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).