3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide

C12H15FN2O2 — CID 103897058

IUPAC3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide
SMILESCC1(NC(=O)c2ccncc2F)CCCOC1
InChIInChI=1S/C12H15FN2O2/c1-12(4-2-6-17-8-12)15-11(16)9-3-5-14-7-10(9)13/h3,5,7H,2,4,6,8H2,1H3,(H,15,16)
InChIKeyOENXQADDSQNHIZ-UHFFFAOYSA-N
MW238.26 g/mol
LogP1.52
Rot. Bonds2

About 3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide

3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide (PubChem CID 103897058) has the molecular formula C12H15FN2O2 and a molecular weight of 238.26 g/mol. Its IUPAC name is 3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide
PubChem CID103897058
Molecular FormulaC12H15FN2O2
Molecular Weight238.26 g/mol
Exact Mass238.11
IUPAC Name3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide
SMILESCC1(NC(=O)c2ccncc2F)CCCOC1
InChIInChI=1S/C12H15FN2O2/c1-12(4-2-6-17-8-12)15-11(16)9-3-5-14-7-10(9)13/h3,5,7H,2,4,6,8H2,1H3,(H,15,16)
InChIKeyOENXQADDSQNHIZ-UHFFFAOYSA-N
XLogP1.52
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.26
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-fluoro-N-(3-methyloxan-3-yl)pyridine-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

3-amino-N-(3-methyloxan-3-yl)pyridine-4-carboxamide
CID 114114566
2-chloro-4,5-difluoro-N-(3-methyloxan-3-yl)benzamide
CID 122159233
5-chloro-2-fluoro-N-(3-methyloxan-3-yl)benzamide
CID 113347966
2-fluoro-N-(3-methyloxolan-3-yl)benzamide
CID 115769256
2-chloro-N-(3-methyloxan-3-yl)furan-3-carboxamide
CID 106812547
2-bromo-4-fluoro-N-(3-methyloxan-3-yl)benzamide
CID 103899264
2-fluoro-4-hydroxy-N-(3-methyloxolan-3-yl)benzamide
CID 104929999
2,6-dichloro-N-(3-methyloxan-3-yl)pyridine-3-carboxamide
CID 114113552
1-[(3-fluoropyridine-4-carbonyl)amino]cycloheptane-1-carboxylic acid
CID 64950656
3-hydrazinyl-N-(4-methyloxan-4-yl)pyridine-4-carboxamide
CID 105072489
4-[(3-methyloxan-3-yl)carbamoyl]benzoic acid
CID 114114464
3-hydrazinyl-N-(1-methylcyclobutyl)pyridine-4-carboxamide
CID 105072481

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide (CID 103897058) is 3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide is CC1(NC(=O)c2ccncc2F)CCCOC1.
What is the InChIKey of 3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide?
The InChIKey is OENXQADDSQNHIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O2/c1-12(4-2-6-17-8-12)15-11(16)9-3-5-14-7-10(9)13/h3,5,7H,2,4,6,8H2,1H3,(H,15,16).
What are the key properties of 3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide?
3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide has a molecular weight of 238.26 g/mol, XLogP of 1.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(3-methyloxan-3-yl)pyridine-4-carboxamide is sourced from PubChem (CID 103897058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).