N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide

C12H20N4O — CID 119996612

IUPACN-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide
SMILESCC(CN)CNC(=O)c1ccc(N(C)C)nc1
InChIInChI=1S/C12H20N4O/c1-9(6-13)7-15-12(17)10-4-5-11(14-8-10)16(2)3/h4-5,8-9H,6-7,13H2,1-3H3,(H,15,17)
InChIKeyOZQIOJSUPFEBRX-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.47
Rot. Bonds5

About N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide

N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide (PubChem CID 119996612) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide
PubChem CID119996612
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC NameN-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide
SMILESCC(CN)CNC(=O)c1ccc(N(C)C)nc1
InChIInChI=1S/C12H20N4O/c1-9(6-13)7-15-12(17)10-4-5-11(14-8-10)16(2)3/h4-5,8-9H,6-7,13H2,1-3H3,(H,15,17)
InChIKeyOZQIOJSUPFEBRX-UHFFFAOYSA-N
XLogP0.47
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-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-(3-amino-2-methylpropyl)-6-[ethyl(propyl)amino]pyridine-3-carboxamide
CID 119997079
6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide
CID 120828209
6-(dimethylamino)-N-(2-hydroxy-4-methylpentyl)pyridine-3-carboxamide
CID 103771018
N-(3-aminobutyl)-6-(dimethylamino)pyridine-3-carboxamide
CID 119497031
2-[[[6-(dimethylamino)pyridine-3-carbonyl]amino]methyl]butanoic acid
CID 65219660
N-[2-(4-chlorophenyl)-2-hydroxyethyl]-6-(dimethylamino)pyridine-3-carboxamide
CID 110888066
N-(3-amino-2-methylpropyl)-6-(azepan-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 119996255
N-(3-amino-2-methylpropyl)-4-methylbenzamide
CID 62668533
6-(dimethylamino)-N-[(2R)-1-hydroxypropan-2-yl]pyridine-3-carboxamide
CID 79031520
6-(diethylamino)-N-(4-hydroxy-2-methylpentyl)pyridine-3-carboxamide
CID 111447882
3-methyl-4-[[6-(N-methylanilino)pyridine-3-carbonyl]amino]butanoic acid
CID 120537159
N-[5-(cyanomethylamino)-3-methyl-5-oxopentyl]-6-(dimethylamino)pyridine-3-carboxamide
CID 57037529

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide (CID 119996612) is N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide is CC(CN)CNC(=O)c1ccc(N(C)C)nc1.
What is the InChIKey of N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide?
The InChIKey is OZQIOJSUPFEBRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-9(6-13)7-15-12(17)10-4-5-11(14-8-10)16(2)3/h4-5,8-9H,6-7,13H2,1-3H3,(H,15,17).
What are the key properties of N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide?
N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide has a molecular weight of 236.32 g/mol, XLogP of 0.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-6-(dimethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 119996612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).