2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide

C15H14F2N2O2 — CID 105380665

IUPAC2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide
SMILESCCCOc1ccccc1NC(=O)c1ccnc(F)c1F
InChIInChI=1S/C15H14F2N2O2/c1-2-9-21-12-6-4-3-5-11(12)19-15(20)10-7-8-18-14(17)13(10)16/h3-8H,2,9H2,1H3,(H,19,20)
InChIKeyFWHKBBNBWXOEED-UHFFFAOYSA-N
MW292.29 g/mol
LogP3.40
Rot. Bonds5

About 2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide

2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide (PubChem CID 105380665) has the molecular formula C15H14F2N2O2 and a molecular weight of 292.29 g/mol. Its IUPAC name is 2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide
PubChem CID105380665
Molecular FormulaC15H14F2N2O2
Molecular Weight292.29 g/mol
Exact Mass292.10
IUPAC Name2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide
SMILESCCCOc1ccccc1NC(=O)c1ccnc(F)c1F
InChIInChI=1S/C15H14F2N2O2/c1-2-9-21-12-6-4-3-5-11(12)19-15(20)10-7-8-18-14(17)13(10)16/h3-8H,2,9H2,1H3,(H,19,20)
InChIKeyFWHKBBNBWXOEED-UHFFFAOYSA-N
XLogP3.40
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(2-ethoxyphenyl)-2,3-difluoropyridine-4-carboxamide
CID 105380223
3-fluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide
CID 115645463
2-amino-N-(2-ethoxyphenyl)-3-fluoropyridine-4-carboxamide
CID 105384040
4-chloro-N-(2-propoxyphenyl)pyridine-3-carboxamide
CID 81226778
methyl N-(2-propoxyphenyl)carbamate
CID 19872099
N-(5-chloro-2-ethoxyphenyl)-2,3-difluoropyridine-4-carboxamide
CID 105380454
7-fluoro-2-methyl-N-(2-propoxyphenyl)quinoline-3-carboxamide
CID 46808171
2,5-dimethyl-N-(2-propoxyphenyl)benzamide
CID 78772580
1-N,4-N-bis(2-butoxyphenyl)benzene-1,4-dicarboxamide
CID 17087319
2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide
CID 17395083
N-(3-ethoxyphenyl)-2,3-difluoropyridine-4-carboxamide
CID 105380453
5-methyl-N-(2-propoxyphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
CID 39093834

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide?
The IUPAC name of 2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide (CID 105380665) is 2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide is CCCOc1ccccc1NC(=O)c1ccnc(F)c1F.
What is the InChIKey of 2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide?
The InChIKey is FWHKBBNBWXOEED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O2/c1-2-9-21-12-6-4-3-5-11(12)19-15(20)10-7-8-18-14(17)13(10)16/h3-8H,2,9H2,1H3,(H,19,20).
What are the key properties of 2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide?
2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide has a molecular weight of 292.29 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 105380665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).