N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide

C16H28N4O — CID 62186803

IUPACN-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)NCC(C)(C)CN(C)C)ccn1
InChIInChI=1S/C16H28N4O/c1-6-8-17-14-10-13(7-9-18-14)15(21)19-11-16(2,3)12-20(4)5/h7,9-10H,6,8,11-12H2,1-5H3,(H,17,18)(H,19,21)
InChIKeyLOVKWLHTLJYZPS-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.22
Rot. Bonds8

About N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide

N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide (PubChem CID 62186803) has the molecular formula C16H28N4O and a molecular weight of 292.43 g/mol. Its IUPAC name is N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide
PubChem CID62186803
Molecular FormulaC16H28N4O
Molecular Weight292.43 g/mol
Exact Mass292.23
IUPAC NameN-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)NCC(C)(C)CN(C)C)ccn1
InChIInChI=1S/C16H28N4O/c1-6-8-17-14-10-13(7-9-18-14)15(21)19-11-16(2,3)12-20(4)5/h7,9-10H,6,8,11-12H2,1-5H3,(H,17,18)(H,19,21)
InChIKeyLOVKWLHTLJYZPS-UHFFFAOYSA-N
XLogP2.22
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)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-(2,2-dimethylpropyl)-2-(propylamino)pyridine-4-carboxamide
CID 62179912
N-[2-(dimethylamino)-2-methylpropyl]-2-(propylamino)pyridine-4-carboxamide
CID 62177285
N-[3-(dimethylamino)propyl]-2-(propylamino)pyridine-4-carboxamide
CID 55042326
2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]pyridine-4-carboxamide
CID 62151627
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-fluoropyridine-4-carboxamide
CID 61293798
N-butyl-2-(propylamino)pyridine-4-carboxamide
CID 62185279
N-[2-(diethylamino)ethyl]-2-(propylamino)pyridine-4-carboxamide
CID 62173284
N-methyl-2-(propylamino)pyridine-4-carboxamide
CID 62170975
N-[2-[methyl(propan-2-yl)amino]ethyl]-2-(propylamino)pyridine-4-carboxamide
CID 62640587
N-[2-[cyclopropyl(methyl)amino]ethyl]-2-(propylamino)pyridine-4-carboxamide
CID 62979979
N-[2-(dimethylamino)-2-methylpropyl]-2-(ethylamino)pyridine-4-carboxamide
CID 62177284
N-butyl-2-[3-(dimethylamino)propylamino]pyridine-4-carboxamide
CID 109165408

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide (CID 62186803) is N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide is CCCNc1cc(C(=O)NCC(C)(C)CN(C)C)ccn1.
What is the InChIKey of N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide?
The InChIKey is LOVKWLHTLJYZPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O/c1-6-8-17-14-10-13(7-9-18-14)15(21)19-11-16(2,3)12-20(4)5/h7,9-10H,6,8,11-12H2,1-5H3,(H,17,18)(H,19,21).
What are the key properties of N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide?
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide has a molecular weight of 292.43 g/mol, XLogP of 2.22, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 62186803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).