2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide

C11H16ClN3O — CID 114922159

IUPAC2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide
SMILESCC(C)CN(C)C(=O)c1cc(N)ncc1Cl
InChIInChI=1S/C11H16ClN3O/c1-7(2)6-15(3)11(16)8-4-10(13)14-5-9(8)12/h4-5,7H,6H2,1-3H3,(H2,13,14)
InChIKeyDMVKEUHUFGPHQG-UHFFFAOYSA-N
MW241.72 g/mol
LogP2.05
Rot. Bonds3

About 2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide

2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide (PubChem CID 114922159) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is 2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide
PubChem CID114922159
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC Name2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide
SMILESCC(C)CN(C)C(=O)c1cc(N)ncc1Cl
InChIInChI=1S/C11H16ClN3O/c1-7(2)6-15(3)11(16)8-4-10(13)14-5-9(8)12/h4-5,7H,6H2,1-3H3,(H2,13,14)
InChIKeyDMVKEUHUFGPHQG-UHFFFAOYSA-N
XLogP2.05
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-amino-5-chloro-N-methyl-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

2-amino-5-chloro-N-(2-methoxyethyl)-N-(2-methylpropyl)pyridine-4-carboxamide
CID 114922590
2-amino-5-chloro-N-(2-methylpropyl)pyridine-4-carboxamide
CID 114921737
2-amino-5-bromo-N-methyl-N-(3-methylbutyl)pyridine-4-carboxamide
CID 114193918
5,6-dichloro-N-methyl-N-(2-methylpropyl)pyridine-3-carboxamide
CID 43243474
2-amino-5-chloro-N-(4-methylpentan-2-yl)pyridine-4-carboxamide
CID 114922209
2-amino-5-chloro-N-ethyl-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide
CID 114924026
2-amino-5-chloro-N-[1-(2-methylpropylamino)-1-oxopropan-2-yl]pyridine-4-carboxamide
CID 114924418
2-amino-N-butan-2-yl-5-chloropyridine-4-carboxamide
CID 114921730
2,5-dichloro-N-[2-(dimethylamino)ethyl]-N-(2-methylpropyl)pyridine-4-carboxamide
CID 114917935
2-amino-5-chloro-N-[4-(dimethylamino)butyl]pyridine-4-carboxamide
CID 114922789
2-amino-5-chloro-N-ethyl-N-(4-methylphenyl)pyridine-4-carboxamide
CID 114922711
2-amino-5-chloro-N-methylpyridine-4-carboxamide
CID 114921748

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide (CID 114922159) is 2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide is CC(C)CN(C)C(=O)c1cc(N)ncc1Cl.
What is the InChIKey of 2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide?
The InChIKey is DMVKEUHUFGPHQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O/c1-7(2)6-15(3)11(16)8-4-10(13)14-5-9(8)12/h4-5,7H,6H2,1-3H3,(H2,13,14).
What are the key properties of 2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide?
2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide has a molecular weight of 241.72 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-chloro-N-methyl-N-(2-methylpropyl)pyridine-4-carboxamide is sourced from PubChem (CID 114922159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).