1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile

C10H9FN2O — CID 67453032

IUPAC1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile
SMILESN#CC1(c2ncccc2F)CC(O)C1
InChIInChI=1S/C10H9FN2O/c11-8-2-1-3-13-9(8)10(6-12)4-7(14)5-10/h1-3,7,14H,4-5H2
InChIKeyNQTUTMXQBMACGI-UHFFFAOYSA-N
MW192.19 g/mol
LogP1.14
Rot. Bonds1

About 1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile

1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile (PubChem CID 67453032) has the molecular formula C10H9FN2O and a molecular weight of 192.19 g/mol. Its IUPAC name is 1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile.

Molecular Properties

Compound Name1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile
PubChem CID67453032
Molecular FormulaC10H9FN2O
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC Name1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile
SMILESN#CC1(c2ncccc2F)CC(O)C1
InChIInChI=1S/C10H9FN2O/c11-8-2-1-3-13-9(8)10(6-12)4-7(14)5-10/h1-3,7,14H,4-5H2
InChIKeyNQTUTMXQBMACGI-UHFFFAOYSA-N
XLogP1.14
TPSA56.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-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-(3-bromo-2-pyridinyl)cyclopropane-1-carbonitrile
CID 118994090
[3-fluoro-1-(3-fluoro-2-pyridinyl)cyclobutyl]methanamine
CID 67453255
1-(3-fluoro-2-pyridinyl)cyclopropane-1-carboxylic acid
CID 84657708
1-(3-fluoro-2-pyridinyl)-4-hydroxypiperidine-4-carbonitrile
CID 86641933
3-fluoro-2-(1-methylcyclobutyl)pyridine
CID 90282613
4-[3,5-difluoro-4-(3-fluoro-2-pyridinyl)phenyl]oxane-4-carbonitrile
CID 141341547
1-(3-fluorophenyl)-3-hydroxycyclohexane-1-carbonitrile
CID 54491185
methyl 3-(3-fluoro-2-pyridinyl)-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate
CID 123958944
3-fluoro-1-pyridin-3-ylcyclobutane-1-carbonitrile
CID 155266174
2-chloro-3-fluoropyridine;3-fluoro-2-(1-isocyano-3-methylidenecyclobutyl)pyridine;3-methylidenecyclobutane-1-carbonitrile
CID 162148029
tert-butyl 3-(3-fluoro-2-pyridinyl)-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxylate
CID 67464903
2-[[3-fluoro-1-(3-fluoro-2-pyridinyl)cyclobutyl]-methylamino]-1,3-benzothiazole-5-carbonitrile
CID 70974800

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile?
The IUPAC name of 1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile (CID 67453032) is 1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile.
What is the SMILES notation for 1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile?
The canonical SMILES for 1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile is N#CC1(c2ncccc2F)CC(O)C1.
What is the InChIKey of 1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile?
The InChIKey is NQTUTMXQBMACGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O/c11-8-2-1-3-13-9(8)10(6-12)4-7(14)5-10/h1-3,7,14H,4-5H2.
What are the key properties of 1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile?
1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile has a molecular weight of 192.19 g/mol, XLogP of 1.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-2-pyridinyl)-3-hydroxycyclobutane-1-carbonitrile is sourced from PubChem (CID 67453032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).