3-fluoro-N,N-dimethylpyridine-4-carboxamide

C8H9FN2O — CID 64950687

IUPAC3-fluoro-N,N-dimethylpyridine-4-carboxamide
SMILESCN(C)C(=O)c1ccncc1F
InChIInChI=1S/C8H9FN2O/c1-11(2)8(12)6-3-4-10-5-7(6)9/h3-5H,1-2H3
InChIKeyWFSKYALEBPWQJD-UHFFFAOYSA-N
MW168.17 g/mol
LogP0.92
Rot. Bonds1

About 3-fluoro-N,N-dimethylpyridine-4-carboxamide

3-fluoro-N,N-dimethylpyridine-4-carboxamide (PubChem CID 64950687) has the molecular formula C8H9FN2O and a molecular weight of 168.17 g/mol. Its IUPAC name is 3-fluoro-N,N-dimethylpyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N,N-dimethylpyridine-4-carboxamide
PubChem CID64950687
Molecular FormulaC8H9FN2O
Molecular Weight168.17 g/mol
Exact Mass168.07
IUPAC Name3-fluoro-N,N-dimethylpyridine-4-carboxamide
SMILESCN(C)C(=O)c1ccncc1F
InChIInChI=1S/C8H9FN2O/c1-11(2)8(12)6-3-4-10-5-7(6)9/h3-5H,1-2H3
InChIKeyWFSKYALEBPWQJD-UHFFFAOYSA-N
XLogP0.92
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.17
LogP ≤ 50.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-fluoro-N,N-dimethylpyridine-4-carboxamide 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

N-cyclohexyl-3-fluoro-N-methylpyridine-4-carboxamide
CID 115645270
3-fluoro-N,N-bis(2-hydroxyethyl)pyridine-4-carboxamide
CID 64950885
N-[2-(dimethylamino)ethyl]-3-fluoro-N-propylpyridine-4-carboxamide
CID 115646479
3-fluoro-N-methyl-N-(pyridin-3-ylmethyl)pyridine-4-carboxamide
CID 113240917
N-(2-cyanoethyl)-3-fluoro-N-methylpyridine-4-carboxamide
CID 64949290
N-(4-ethylphenyl)-3-fluoro-N-methylpyridine-4-carboxamide
CID 105066566
N-(3-amino-2,2-dimethylpropyl)-3-fluoro-N-methylpyridine-4-carboxamide
CID 79652581
N-[4-(aminomethyl)phenyl]-3-fluoro-N-methylpyridine-4-carboxamide
CID 64949854
N-(1-cyanopropan-2-yl)-3-fluoro-N-methylpyridine-4-carboxamide
CID 64949105
3-fluoro-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyridine-4-carboxamide
CID 113240790
N-[2-(dimethylamino)ethyl]-3-fluoro-N-(2-methylpropyl)pyridine-4-carboxamide
CID 115646478
N-[[1-(dimethylamino)cyclobutyl]methyl]-3-fluoro-N-methylpyridine-4-carboxamide
CID 105416291

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N,N-dimethylpyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N,N-dimethylpyridine-4-carboxamide (CID 64950687) is 3-fluoro-N,N-dimethylpyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N,N-dimethylpyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N,N-dimethylpyridine-4-carboxamide is CN(C)C(=O)c1ccncc1F.
What is the InChIKey of 3-fluoro-N,N-dimethylpyridine-4-carboxamide?
The InChIKey is WFSKYALEBPWQJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FN2O/c1-11(2)8(12)6-3-4-10-5-7(6)9/h3-5H,1-2H3.
What are the key properties of 3-fluoro-N,N-dimethylpyridine-4-carboxamide?
3-fluoro-N,N-dimethylpyridine-4-carboxamide has a molecular weight of 168.17 g/mol, XLogP of 0.92, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N,N-dimethylpyridine-4-carboxamide is sourced from PubChem (CID 64950687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).