4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide

C18H23N3O2 — CID 109217852

IUPAC4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide
SMILESCCCCN(C)c1ccnc(C(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C18H23N3O2/c1-4-5-12-21(2)14-10-11-19-16(13-14)18(22)20-15-8-6-7-9-17(15)23-3/h6-11,13H,4-5,12H2,1-3H3,(H,20,22)
InChIKeyYUVKCCQUGAQJHX-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.58
Rot. Bonds7

About 4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide

4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide (PubChem CID 109217852) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is 4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide
PubChem CID109217852
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC Name4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide
SMILESCCCCN(C)c1ccnc(C(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C18H23N3O2/c1-4-5-12-21(2)14-10-11-19-16(13-14)18(22)20-15-8-6-7-9-17(15)23-3/h6-11,13H,4-5,12H2,1-3H3,(H,20,22)
InChIKeyYUVKCCQUGAQJHX-UHFFFAOYSA-N
XLogP3.58
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-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-methoxyphenyl)-4-(N-methylanilino)pyridine-2-carboxamide
CID 109219451
4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109214268
4-(N-ethylanilino)-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 109220319
methyl 3-[[4-[butyl(methyl)amino]pyridine-2-carbonyl]amino]-4-chlorobenzoate
CID 109217873
2-[butyl(methyl)amino]-N-(2-methoxyphenyl)-6-methylpyrimidine-4-carboxamide
CID 109333574
5-[butyl(methyl)amino]-N-(2-ethoxyphenyl)pyridine-2-carboxamide
CID 109196077
4-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide
CID 109217835
4-[butyl(methyl)amino]-N-(4-phenylmethoxyphenyl)pyridine-2-carboxamide
CID 109217883
4-[butyl(methyl)amino]-N-pentylpyridine-2-carboxamide
CID 109217497
4-[butyl(methyl)amino]-N-(4-tert-butylphenyl)pyridine-2-carboxamide
CID 109217837
2-N-(2-methoxyphenyl)-4-N-methyl-4-N-phenylpyridine-2,4-dicarboxamide
CID 109091430
5-[butyl(methyl)amino]-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109196079

Frequently Asked Questions

What is the IUPAC name of 4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide?
The IUPAC name of 4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide (CID 109217852) is 4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide is CCCCN(C)c1ccnc(C(=O)Nc2ccccc2OC)c1.
What is the InChIKey of 4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide?
The InChIKey is YUVKCCQUGAQJHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2/c1-4-5-12-21(2)14-10-11-19-16(13-14)18(22)20-15-8-6-7-9-17(15)23-3/h6-11,13H,4-5,12H2,1-3H3,(H,20,22).
What are the key properties of 4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide?
4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide has a molecular weight of 313.40 g/mol, XLogP of 3.58, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[butyl(methyl)amino]-N-(2-methoxyphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109217852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).