1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea

C14H19FN2O2 — CID 106125111

IUPAC1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea
SMILESO=C(NCC1CCC(O)CC1)Nc1ccccc1F
InChIInChI=1S/C14H19FN2O2/c15-12-3-1-2-4-13(12)17-14(19)16-9-10-5-7-11(18)8-6-10/h1-4,10-11,18H,5-9H2,(H2,16,17,19)
InChIKeyBSVIEWARPMZKIG-UHFFFAOYSA-N
MW266.32 g/mol
LogP2.50
Rot. Bonds3

About 1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea

1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea (PubChem CID 106125111) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea.

Molecular Properties

Compound Name1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea
PubChem CID106125111
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC Name1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea
SMILESO=C(NCC1CCC(O)CC1)Nc1ccccc1F
InChIInChI=1S/C14H19FN2O2/c15-12-3-1-2-4-13(12)17-14(19)16-9-10-5-7-11(18)8-6-10/h1-4,10-11,18H,5-9H2,(H2,16,17,19)
InChIKeyBSVIEWARPMZKIG-UHFFFAOYSA-N
XLogP2.50
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 52.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclopropylmethyl)-3-(2,5-difluorophenyl)urea
CID 3873240
1-(2,3-difluorophenyl)-3-[(3-hydroxycyclohexyl)methyl]urea
CID 111474346
1-(2-fluorophenyl)-3-[(1-pyridin-3-ylpiperidin-4-yl)methyl]urea
CID 91624876
1-[2-(cyclopropylamino)ethyl]-3-(2-fluorophenyl)urea
CID 62663672
1-[(3-hydroxycyclobutyl)methyl]-3-[2-(trifluoromethyl)phenyl]urea
CID 66004158
1-(2-fluorophenyl)-3-[(3-methylpiperidin-2-yl)methyl]urea
CID 63304885
2-chloro-N-[[2-(cyclopropylmethylcarbamoyl)phenyl]carbamoyl]-6-fluorobenzamide
CID 2799401
1-(2,4-difluorophenyl)-3-[[1-[(2-fluorophenyl)methyl]piperidin-4-yl]methyl]urea
CID 15989563
N-(cyclopropylmethyl)-2-[2-(2-fluoroanilino)-2-oxoethoxy]benzamide
CID 34822016
1-(3-chlorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea
CID 106124989
2-(cyclohexylmethylamino)-N-(2-fluorophenyl)acetamide
CID 43215446
1-(2,4-difluorophenyl)-3-(oxan-4-ylmethyl)urea
CID 108912997

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea?
The IUPAC name of 1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea (CID 106125111) is 1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea.
What is the SMILES notation for 1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea?
The canonical SMILES for 1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea is O=C(NCC1CCC(O)CC1)Nc1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea?
The InChIKey is BSVIEWARPMZKIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2/c15-12-3-1-2-4-13(12)17-14(19)16-9-10-5-7-11(18)8-6-10/h1-4,10-11,18H,5-9H2,(H2,16,17,19).
What are the key properties of 1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea?
1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea has a molecular weight of 266.32 g/mol, XLogP of 2.50, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-3-[(4-hydroxycyclohexyl)methyl]urea is sourced from PubChem (CID 106125111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).