2-fluoro-N-methyl-N-propylpyridine-4-carboxamide

C10H13FN2O — CID 61293439

IUPAC2-fluoro-N-methyl-N-propylpyridine-4-carboxamide
SMILESCCCN(C)C(=O)c1ccnc(F)c1
InChIInChI=1S/C10H13FN2O/c1-3-6-13(2)10(14)8-4-5-12-9(11)7-8/h4-5,7H,3,6H2,1-2H3
InChIKeyRWZGNPPPQHBXLZ-UHFFFAOYSA-N
MW196.22 g/mol
LogP1.70
Rot. Bonds3

About 2-fluoro-N-methyl-N-propylpyridine-4-carboxamide

2-fluoro-N-methyl-N-propylpyridine-4-carboxamide (PubChem CID 61293439) has the molecular formula C10H13FN2O and a molecular weight of 196.22 g/mol. Its IUPAC name is 2-fluoro-N-methyl-N-propylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-fluoro-N-methyl-N-propylpyridine-4-carboxamide
PubChem CID61293439
Molecular FormulaC10H13FN2O
Molecular Weight196.22 g/mol
Exact Mass196.10
IUPAC Name2-fluoro-N-methyl-N-propylpyridine-4-carboxamide
SMILESCCCN(C)C(=O)c1ccnc(F)c1
InChIInChI=1S/C10H13FN2O/c1-3-6-13(2)10(14)8-4-5-12-9(11)7-8/h4-5,7H,3,6H2,1-2H3
InChIKeyRWZGNPPPQHBXLZ-UHFFFAOYSA-N
XLogP1.70
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.22
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(dimethylamino)ethyl]-2-fluoro-N-methylpyridine-4-carboxamide
CID 63693462
2-fluoro-N-(5-hydroxypentyl)-N-methylpyridine-4-carboxamide
CID 107199083
2-fluoro-N-methyl-N-(2-propan-2-yloxyethyl)pyridine-4-carboxamide
CID 80710277
2-fluoro-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyridine-4-carboxamide
CID 61294360
2-fluoro-N-methyl-N-(2-pyrrolidin-1-ylethyl)pyridine-4-carboxamide
CID 63207878
2-fluoro-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide
CID 63929110
2-fluoro-N-[2-(2-fluorophenoxy)ethyl]-N-methylpyridine-4-carboxamide
CID 61294548
ethyl 2-[(2-fluoropyridine-4-carbonyl)-propylamino]acetate
CID 55007165
2-fluoro-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]pyridine-4-carboxamide
CID 61292900
N-[2-(dimethylamino)-2-oxoethyl]-N-ethyl-2-fluoropyridine-4-carboxamide
CID 61292713
N-(2-cyanopropyl)-2-fluoro-N-methylpyridine-4-carboxamide
CID 61293660
4-fluoro-N-methyl-N-propylbenzamide
CID 60928889

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-methyl-N-propylpyridine-4-carboxamide?
The IUPAC name of 2-fluoro-N-methyl-N-propylpyridine-4-carboxamide (CID 61293439) is 2-fluoro-N-methyl-N-propylpyridine-4-carboxamide.
What is the SMILES notation for 2-fluoro-N-methyl-N-propylpyridine-4-carboxamide?
The canonical SMILES for 2-fluoro-N-methyl-N-propylpyridine-4-carboxamide is CCCN(C)C(=O)c1ccnc(F)c1.
What is the InChIKey of 2-fluoro-N-methyl-N-propylpyridine-4-carboxamide?
The InChIKey is RWZGNPPPQHBXLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O/c1-3-6-13(2)10(14)8-4-5-12-9(11)7-8/h4-5,7H,3,6H2,1-2H3.
What are the key properties of 2-fluoro-N-methyl-N-propylpyridine-4-carboxamide?
2-fluoro-N-methyl-N-propylpyridine-4-carboxamide has a molecular weight of 196.22 g/mol, XLogP of 1.70, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-methyl-N-propylpyridine-4-carboxamide is sourced from PubChem (CID 61293439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).