1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea

C15H22N2O2 — CID 71786227

IUPAC1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea
SMILESO=C(NCCc1ccccc1)NC1CCCC(O)C1
InChIInChI=1S/C15H22N2O2/c18-14-8-4-7-13(11-14)17-15(19)16-10-9-12-5-2-1-3-6-12/h1-3,5-6,13-14,18H,4,7-11H2,(H2,16,17,19)
InChIKeyOMXRWRWCWJSFJO-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.83
Rot. Bonds4

About 1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea

1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea (PubChem CID 71786227) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea.

Molecular Properties

Compound Name1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea
PubChem CID71786227
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea
SMILESO=C(NCCc1ccccc1)NC1CCCC(O)C1
InChIInChI=1S/C15H22N2O2/c18-14-8-4-7-13(11-14)17-15(19)16-10-9-12-5-2-1-3-6-12/h1-3,5-6,13-14,18H,4,7-11H2,(H2,16,17,19)
InChIKeyOMXRWRWCWJSFJO-UHFFFAOYSA-N
XLogP1.83
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-methylcyclohexyl)-3-(2-phenylethyl)urea
CID 47186131
1-(3-hydroxycyclohexyl)-3-[2-(4-methoxyphenyl)ethyl]urea
CID 71786236
benzyl N-(3-hydroxycyclohexyl)carbamate
CID 14476840
1-(2-phenylethyl)-3-[(1R,2R,6S,7S,8R)-8-tricyclo[5.2.1.02,6]decanyl]urea
CID 124739142
1-(2-phenylethyl)-3-[(1R,2S,6R,7S,8R)-8-tricyclo[5.2.1.02,6]decanyl]urea
CID 124739144
1-(1-methylpiperidin-4-yl)-3-(2-phenylethyl)urea
CID 11499904
1-(2-phenylethyl)-3-(4-pyrimidin-2-yloxycyclohexyl)urea
CID 91626320
1-[(4-chlorophenyl)methyl]-3-[(1S,3R)-3-hydroxycyclohexyl]urea
CID 95983968
1-cyclopropyl-3-(4-phenylbutyl)urea
CID 108887631
3-methyl-N-[2-(2-phenylethylcarbamoylamino)cyclohexyl]but-2-enamide
CID 23850327
1-[2-(4-bromophenyl)ethyl]-3-cyclopentylurea
CID 110775638
1-ethyl-3-(3-hydroxycyclohexyl)urea
CID 103618902

Frequently Asked Questions

What is the IUPAC name of 1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea?
The IUPAC name of 1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea (CID 71786227) is 1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea.
What is the SMILES notation for 1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea?
The canonical SMILES for 1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea is O=C(NCCc1ccccc1)NC1CCCC(O)C1.
What is the InChIKey of 1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea?
The InChIKey is OMXRWRWCWJSFJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c18-14-8-4-7-13(11-14)17-15(19)16-10-9-12-5-2-1-3-6-12/h1-3,5-6,13-14,18H,4,7-11H2,(H2,16,17,19).
What are the key properties of 1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea?
1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea has a molecular weight of 262.35 g/mol, XLogP of 1.83, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydroxycyclohexyl)-3-(2-phenylethyl)urea is sourced from PubChem (CID 71786227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).