1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea

C16H21FN2O2 — CID 60573056

IUPAC1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea
SMILESO=C(NC1CCC(O)CC1)NC1CCc2cc(F)ccc21
InChIInChI=1S/C16H21FN2O2/c17-11-2-7-14-10(9-11)1-8-15(14)19-16(21)18-12-3-5-13(20)6-4-12/h2,7,9,12-13,15,20H,1,3-6,8H2,(H2,18,19,21)
InChIKeyHKOGSRKJMZPISW-UHFFFAOYSA-N
MW292.35 g/mol
LogP2.42
Rot. Bonds2

About 1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea

1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea (PubChem CID 60573056) has the molecular formula C16H21FN2O2 and a molecular weight of 292.35 g/mol. Its IUPAC name is 1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea.

Molecular Properties

Compound Name1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea
PubChem CID60573056
Molecular FormulaC16H21FN2O2
Molecular Weight292.35 g/mol
Exact Mass292.16
IUPAC Name1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea
SMILESO=C(NC1CCC(O)CC1)NC1CCc2cc(F)ccc21
InChIInChI=1S/C16H21FN2O2/c17-11-2-7-14-10(9-11)1-8-15(14)19-16(21)18-12-3-5-13(20)6-4-12/h2,7,9,12-13,15,20H,1,3-6,8H2,(H2,18,19,21)
InChIKeyHKOGSRKJMZPISW-UHFFFAOYSA-N
XLogP2.42
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.35
LogP ≤ 52.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(2-Fluorophenyl)ethyl]-3-(4-hydroxycyclohexyl)urea
CID 45875839
3-(2-Cyclohexyl-2-hydroxyethyl)-1-[(4-fluorophenyl)methyl]urea
CID 56764368
1-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-3-[2-(4-methoxypiperidin-1-yl)ethyl]urea
CID 71860616
1-(6-fluoro-2,3-dihydro-1H-inden-1-yl)-3-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]urea
CID 71864356
3-(2,3-dihydro-1H-inden-1-yl)-1-[(2-hydroxycyclohexyl)methyl]-1-methylurea
CID 75518095
1-[2-(2,3-dihydro-1H-inden-2-yl)ethyl]-3-(4-hydroxycyclohexyl)urea
CID 122132319
1-(4-Hydroxycyclohexyl)-3-{[2-methyl-4-(trifluoromethyl)phenyl]methyl}urea
CID 99826064
(2R)-4-(3,5-difluorophenyl)-1-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]butan-2-ol
CID 68608195
(2R)-4-(3,5-difluorophenyl)-1-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]butan-2-ol
CID 68608558
[(2S,3R)-1-(3,5-difluorophenyl)-4-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-3-hydroxybutan-2-yl]carbamic acid
CID 69420817
[(2S,3S)-1-(3,5-difluorophenyl)-4-[[(1R)-2,3-dihydro-1H-inden-1-yl]amino]-3-hydroxybutan-2-yl]carbamic acid
CID 69420822
[(2S,3R)-1-(3,5-difluorophenyl)-4-[[(1S)-2,3-dihydro-1H-inden-1-yl]amino]-3-hydroxybutan-2-yl]carbamic acid
CID 69422996

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea?
The IUPAC name of 1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea (CID 60573056) is 1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea.
What is the SMILES notation for 1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea?
The canonical SMILES for 1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea is O=C(NC1CCC(O)CC1)NC1CCc2cc(F)ccc21.
What is the InChIKey of 1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea?
The InChIKey is HKOGSRKJMZPISW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN2O2/c17-11-2-7-14-10(9-11)1-8-15(14)19-16(21)18-12-3-5-13(20)6-4-12/h2,7,9,12-13,15,20H,1,3-6,8H2,(H2,18,19,21).
What are the key properties of 1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea?
1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea has a molecular weight of 292.35 g/mol, XLogP of 2.42, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-3-(4-hydroxycyclohexyl)urea is sourced from PubChem (CID 60573056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).