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

C13H17FN2O2 — CID 60612560

IUPAC1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea
SMILESO=C(Nc1ccccc1F)NC1CCCCC1O
InChIInChI=1S/C13H17FN2O2/c14-9-5-1-2-6-10(9)15-13(18)16-11-7-3-4-8-12(11)17/h1-2,5-6,11-12,17H,3-4,7-8H2,(H2,15,16,18)
InChIKeyLMFUYLIMAJUMQS-UHFFFAOYSA-N
MW252.29 g/mol
LogP2.25
Rot. Bonds2

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

1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea (PubChem CID 60612560) has the molecular formula C13H17FN2O2 and a molecular weight of 252.29 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea.

Molecular Properties

Compound Name1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea
PubChem CID60612560
Molecular FormulaC13H17FN2O2
Molecular Weight252.29 g/mol
Exact Mass252.13
IUPAC Name1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea
SMILESO=C(Nc1ccccc1F)NC1CCCCC1O
InChIInChI=1S/C13H17FN2O2/c14-9-5-1-2-6-10(9)15-13(18)16-11-7-3-4-8-12(11)17/h1-2,5-6,11-12,17H,3-4,7-8H2,(H2,15,16,18)
InChIKeyLMFUYLIMAJUMQS-UHFFFAOYSA-N
XLogP2.25
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.29
LogP ≤ 52.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-difluorophenyl)-3-(2-hydroxycyclohexyl)urea
CID 47091282
1-(2-hydroxycyclohexyl)-3-(2,3,4-trifluorophenyl)urea
CID 75948763
1-(2-hydroxycyclohexyl)-3-(2,4,5-trifluorophenyl)urea
CID 111103807
1-(2-aminocyclopropyl)-3-(2-fluorophenyl)urea
CID 43596595
1-(2-hydroxycyclohexyl)-3-(2-propan-2-yloxyphenyl)urea
CID 110933007
1-(2-hydroxycyclohexyl)-3-(3,4,5-trifluorophenyl)urea
CID 111459001
trans-(1S,2S)-2-(2-fluoroanilino)cyclopentan-1-ol
CID 93345872
4-fluoro-2-[(2-hydroxycyclohexyl)carbamoylamino]benzoic acid
CID 62358546
1-(2-fluorophenyl)-3-piperidin-4-ylurea
CID 16785411
1-(2-hydroxycyclohexyl)-3-pyridin-2-ylurea
CID 51105726
1-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(2-hydroxycyclohexyl)urea
CID 110933179
1-(2,5-dimethylphenyl)-3-(2-hydroxycyclohexyl)urea
CID 75948752

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea?
The IUPAC name of 1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea (CID 60612560) is 1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea.
What is the SMILES notation for 1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea?
The canonical SMILES for 1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea is O=C(Nc1ccccc1F)NC1CCCCC1O.
What is the InChIKey of 1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea?
The InChIKey is LMFUYLIMAJUMQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2O2/c14-9-5-1-2-6-10(9)15-13(18)16-11-7-3-4-8-12(11)17/h1-2,5-6,11-12,17H,3-4,7-8H2,(H2,15,16,18).
What are the key properties of 1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea?
1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea has a molecular weight of 252.29 g/mol, XLogP of 2.25, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-3-(2-hydroxycyclohexyl)urea is sourced from PubChem (CID 60612560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).