N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide

C13H21N3O — CID 62241135

IUPACN-butan-2-yl-6-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1cccc(C(=O)NC(C)CC)n1
InChIInChI=1S/C13H21N3O/c1-4-9-14-12-8-6-7-11(16-12)13(17)15-10(3)5-2/h6-8,10H,4-5,9H2,1-3H3,(H,14,16)(H,15,17)
InChIKeyQJQNWHUJONJMLP-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.43
Rot. Bonds6

About N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide

N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide (PubChem CID 62241135) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-butan-2-yl-6-(propylamino)pyridine-2-carboxamide
PubChem CID62241135
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN-butan-2-yl-6-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1cccc(C(=O)NC(C)CC)n1
InChIInChI=1S/C13H21N3O/c1-4-9-14-12-8-6-7-11(16-12)13(17)15-10(3)5-2/h6-8,10H,4-5,9H2,1-3H3,(H,14,16)(H,15,17)
InChIKeyQJQNWHUJONJMLP-UHFFFAOYSA-N
XLogP2.43
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-butan-2-yl-6-(propylamino)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-propan-2-yl-6-(propylamino)pyridine-2-carboxamide
CID 62240109
N-(6-methylheptan-2-yl)-6-(propylamino)pyridine-2-carboxamide
CID 63499181
N-octan-4-yl-6-(propylamino)pyridine-2-carboxamide
CID 106027806
N-(3-methyl-2-propan-2-ylbutyl)-6-(propylamino)pyridine-2-carboxamide
CID 102907982
6-[[3-(butan-2-ylamino)-3-oxopropyl]amino]pyridine-2-carboxylic acid
CID 62238876
N-[1-(dimethylamino)propan-2-yl]-6-(ethylamino)pyridine-2-carboxamide
CID 82949517
6-(ethylamino)-N-(4-methoxybutan-2-yl)pyridine-2-carboxamide
CID 64604327
N-(4-propan-2-yl-1,3-thiazol-2-yl)-6-(propylamino)pyridine-2-carboxamide
CID 62239162
6-N-butan-2-yl-2-N-cyclopropylpyridine-2,6-dicarboxamide
CID 109093809
N-butan-2-yl-6-methoxypyridine-2-carboxamide
CID 110848498
N-[2-(ethylamino)-2-oxoethyl]-6-(propylamino)pyridine-2-carboxamide
CID 55052141
N-methyl-N-pentan-2-yl-6-(propylamino)pyridine-2-carboxamide
CID 55052478

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide?
The IUPAC name of N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide (CID 62241135) is N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide?
The canonical SMILES for N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide is CCCNc1cccc(C(=O)NC(C)CC)n1.
What is the InChIKey of N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide?
The InChIKey is QJQNWHUJONJMLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-4-9-14-12-8-6-7-11(16-12)13(17)15-10(3)5-2/h6-8,10H,4-5,9H2,1-3H3,(H,14,16)(H,15,17).
What are the key properties of N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide?
N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide has a molecular weight of 235.33 g/mol, XLogP of 2.43, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-6-(propylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62241135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).