3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide

C13H19FN2O2 — CID 113240831

IUPAC3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide
SMILESCOCCN(CC(C)C)C(=O)c1ccncc1F
InChIInChI=1S/C13H19FN2O2/c1-10(2)9-16(6-7-18-3)13(17)11-4-5-15-8-12(11)14/h4-5,8,10H,6-7,9H2,1-3H3
InChIKeyWMGDKWJPUYILSL-UHFFFAOYSA-N
MW254.30 g/mol
LogP1.97
Rot. Bonds6

About 3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide

3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide (PubChem CID 113240831) has the molecular formula C13H19FN2O2 and a molecular weight of 254.30 g/mol. Its IUPAC name is 3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide
PubChem CID113240831
Molecular FormulaC13H19FN2O2
Molecular Weight254.30 g/mol
Exact Mass254.14
IUPAC Name3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide
SMILESCOCCN(CC(C)C)C(=O)c1ccncc1F
InChIInChI=1S/C13H19FN2O2/c1-10(2)9-16(6-7-18-3)13(17)11-4-5-15-8-12(11)14/h4-5,8,10H,6-7,9H2,1-3H3
InChIKeyWMGDKWJPUYILSL-UHFFFAOYSA-N
XLogP1.97
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.30
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)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

N-[2-(dimethylamino)ethyl]-3-fluoro-N-(2-methylpropyl)pyridine-4-carboxamide
CID 115646478
N-(1-cyclopropylethyl)-3-fluoro-N-(2-methoxyethyl)pyridine-4-carboxamide
CID 115645950
2-(ethylamino)-3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide
CID 105385257
3-fluoro-N,N-bis(2-hydroxyethyl)pyridine-4-carboxamide
CID 64950885
6-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 113323490
3-amino-2,6-difluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)benzamide
CID 79773295
5-amino-N-(2-methoxyethyl)-2-methyl-N-(2-methylpropyl)pyridine-3-carboxamide
CID 61107661
1-(3-fluoro-4-pyridinyl)-4-methoxybutan-1-one
CID 104737858
N-[2-(dimethylamino)ethyl]-3-fluoro-N-propylpyridine-4-carboxamide
CID 115646479
2-[(3-bromopyridine-4-carbonyl)-(2-methoxyethyl)amino]acetic acid
CID 120516189
3-amino-N-(2-methoxyethyl)-2-methyl-N-(2-methylpropyl)benzamide
CID 61105794
3-fluoro-N,N-dimethylpyridine-4-carboxamide
CID 64950687

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide (CID 113240831) is 3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide is COCCN(CC(C)C)C(=O)c1ccncc1F.
What is the InChIKey of 3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide?
The InChIKey is WMGDKWJPUYILSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2O2/c1-10(2)9-16(6-7-18-3)13(17)11-4-5-15-8-12(11)14/h4-5,8,10H,6-7,9H2,1-3H3.
What are the key properties of 3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide?
3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide has a molecular weight of 254.30 g/mol, XLogP of 1.97, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide is sourced from PubChem (CID 113240831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).