2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide

C12H16ClN3O — CID 113246075

IUPAC2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide
SMILESCCCC1CC1NC(=O)c1cc(N)nc(Cl)c1
InChIInChI=1S/C12H16ClN3O/c1-2-3-7-4-9(7)15-12(17)8-5-10(13)16-11(14)6-8/h5-7,9H,2-4H2,1H3,(H2,14,16)(H,15,17)
InChIKeyZXZJCJQKFOPVKK-UHFFFAOYSA-N
MW253.73 g/mol
LogP2.24
Rot. Bonds4

About 2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide

2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide (PubChem CID 113246075) has the molecular formula C12H16ClN3O and a molecular weight of 253.73 g/mol. Its IUPAC name is 2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide
PubChem CID113246075
Molecular FormulaC12H16ClN3O
Molecular Weight253.73 g/mol
Exact Mass253.10
IUPAC Name2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide
SMILESCCCC1CC1NC(=O)c1cc(N)nc(Cl)c1
InChIInChI=1S/C12H16ClN3O/c1-2-3-7-4-9(7)15-12(17)8-5-10(13)16-11(14)6-8/h5-7,9H,2-4H2,1H3,(H2,14,16)(H,15,17)
InChIKeyZXZJCJQKFOPVKK-UHFFFAOYSA-N
XLogP2.24
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.73
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-amino-6-chloro-N-(2-propylcyclopropyl)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

2,6-dichloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide
CID 103713551
2-amino-6-chloro-N-(4-propylcyclohexyl)pyridine-4-carboxamide
CID 62161947
2-chloro-N-(2-ethylcyclopropyl)-6-propylpyridine-4-carboxamide
CID 114107737
3-amino-5-iodo-N-(2-propylcyclopropyl)benzamide
CID 112750965
2-amino-6-chloro-N-(2-methylcyclopentyl)pyridine-4-carboxamide
CID 63279653
2-chloro-6-(ethylamino)-N-(2-ethylcyclopropyl)pyridine-4-carboxamide
CID 114109652
6-amino-N-(2-propylcyclopropyl)pyridine-2-carboxamide
CID 103832172
2-amino-6-chloro-N-(5-oxopyrrolidin-3-yl)pyridine-4-carboxamide
CID 113429248
4-bromo-N-(2-propylcyclopropyl)-3-sulfamoylbenzamide
CID 103713871
2-amino-N-butan-2-yl-6-chloropyridine-4-carboxamide
CID 62155359
3-iodo-N-(2-propylcyclopropyl)benzamide
CID 103713511
N-(1-adamantyl)-2-amino-6-chloropyridine-4-carboxamide
CID 62153371

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide (CID 113246075) is 2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide is CCCC1CC1NC(=O)c1cc(N)nc(Cl)c1.
What is the InChIKey of 2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide?
The InChIKey is ZXZJCJQKFOPVKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN3O/c1-2-3-7-4-9(7)15-12(17)8-5-10(13)16-11(14)6-8/h5-7,9H,2-4H2,1H3,(H2,14,16)(H,15,17).
What are the key properties of 2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide?
2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide has a molecular weight of 253.73 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-chloro-N-(2-propylcyclopropyl)pyridine-4-carboxamide is sourced from PubChem (CID 113246075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).