1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile

C10H8FNO — CID 84767283

IUPAC1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile
SMILESN#CC1(c2ccc(F)cc2O)CC1
InChIInChI=1S/C10H8FNO/c11-7-1-2-8(9(13)5-7)10(6-12)3-4-10/h1-2,5,13H,3-4H2
InChIKeyFCKARWSSNMDAAA-UHFFFAOYSA-N
MW177.18 g/mol
LogP2.09
Rot. Bonds1

About 1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile

1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile (PubChem CID 84767283) has the molecular formula C10H8FNO and a molecular weight of 177.18 g/mol. Its IUPAC name is 1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile.

Molecular Properties

Compound Name1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile
PubChem CID84767283
Molecular FormulaC10H8FNO
Molecular Weight177.18 g/mol
Exact Mass177.06
IUPAC Name1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile
SMILESN#CC1(c2ccc(F)cc2O)CC1
InChIInChI=1S/C10H8FNO/c11-7-1-2-8(9(13)5-7)10(6-12)3-4-10/h1-2,5,13H,3-4H2
InChIKeyFCKARWSSNMDAAA-UHFFFAOYSA-N
XLogP2.09
TPSA44.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.18
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile 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-(2,4-difluorophenyl)cycloheptane-1-carbonitrile
CID 64560794
1-(5-chloro-4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile
CID 84781942
1-(4-bromo-2-fluorophenyl)cyclopropane-1-carbonitrile
CID 58762329
1-(2,3-dihydroxyphenyl)cyclopropane-1-carbonitrile
CID 131587924
4-(4-fluoro-2-hydroxyphenyl)oxan-4-ol
CID 117104442
1-(2-fluoro-4-formylphenyl)cyclopropane-1-carbonitrile
CID 177016890
1-(5-chloro-3-fluoro-2,4-dihydroxyphenyl)cyclopropane-1-carbonitrile
CID 84791665
1-(5-fluoro-1-hydroxy-2,3-dihydroinden-1-yl)cyclopentane-1-carbonitrile
CID 116532491
1-(3,5-difluorophenyl)cyclopropane-1-carbonitrile
CID 53402677
2-(2-chloro-4-fluorophenyl)spiro[3.6]decane-2-carbonitrile
CID 65007552
8-fluoro-5-hydroxy-3,4-dihydro-2H-1-benzoxepine-5-carbonitrile
CID 82241492
1-(4,5-difluoro-2-methylphenyl)cyclopropane-1-carbonitrile
CID 84772596

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile?
The IUPAC name of 1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile (CID 84767283) is 1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile.
What is the SMILES notation for 1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile?
The canonical SMILES for 1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile is N#CC1(c2ccc(F)cc2O)CC1.
What is the InChIKey of 1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile?
The InChIKey is FCKARWSSNMDAAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNO/c11-7-1-2-8(9(13)5-7)10(6-12)3-4-10/h1-2,5,13H,3-4H2.
What are the key properties of 1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile?
1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile has a molecular weight of 177.18 g/mol, XLogP of 2.09, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-2-hydroxyphenyl)cyclopropane-1-carbonitrile is sourced from PubChem (CID 84767283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).