6-amino-5-chloro-N-propylpyridine-3-carboxamide

C9H12ClN3O — CID 62156037

IUPAC6-amino-5-chloro-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1cnc(N)c(Cl)c1
InChIInChI=1S/C9H12ClN3O/c1-2-3-12-9(14)6-4-7(10)8(11)13-5-6/h4-5H,2-3H2,1H3,(H2,11,13)(H,12,14)
InChIKeyRVKXPMHEZMAVJL-UHFFFAOYSA-N
MW213.67 g/mol
LogP1.46
Rot. Bonds3

About 6-amino-5-chloro-N-propylpyridine-3-carboxamide

6-amino-5-chloro-N-propylpyridine-3-carboxamide (PubChem CID 62156037) has the molecular formula C9H12ClN3O and a molecular weight of 213.67 g/mol. Its IUPAC name is 6-amino-5-chloro-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-5-chloro-N-propylpyridine-3-carboxamide
PubChem CID62156037
Molecular FormulaC9H12ClN3O
Molecular Weight213.67 g/mol
Exact Mass213.07
IUPAC Name6-amino-5-chloro-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1cnc(N)c(Cl)c1
InChIInChI=1S/C9H12ClN3O/c1-2-3-12-9(14)6-4-7(10)8(11)13-5-6/h4-5H,2-3H2,1H3,(H2,11,13)(H,12,14)
InChIKeyRVKXPMHEZMAVJL-UHFFFAOYSA-N
XLogP1.46
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.67
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-5-chloro-N-[3-(dimethylamino)propyl]pyridine-3-carboxamide
CID 55041683
6-amino-5-chloro-N-(2-phenylethyl)pyridine-3-carboxamide
CID 55043054
6-amino-5-chloro-N-(2-cyclopentylethyl)pyridine-3-carboxamide
CID 62161812
6-amino-5-chloro-N-[2-[cyclopropyl(methyl)amino]ethyl]pyridine-3-carboxamide
CID 62728599
6-amino-5-chloro-N-[2-(2-methylphenyl)ethyl]pyridine-3-carboxamide
CID 78990903
6-amino-5-chloro-N-hydroxypyridine-3-carboxamide
CID 130615065
6-amino-5-chloro-N-(2-methyl-2-methylsulfonylpropyl)pyridine-3-carboxamide
CID 79555286
6-amino-N-benzyl-5-chloropyridine-3-carboxamide
CID 62153073
6-amino-5-chloro-N-(cyclobutylmethyl)pyridine-3-carboxamide
CID 62155457
6-amino-5-chloro-N-(2-phenylpropyl)pyridine-3-carboxamide
CID 115601161
6-amino-5-chloro-N-[(4-propan-2-ylphenyl)methyl]pyridine-3-carboxamide
CID 62186973
6-amino-5-chloro-N-[(2-fluorophenyl)methyl]pyridine-3-carboxamide
CID 55043681

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-chloro-N-propylpyridine-3-carboxamide?
The IUPAC name of 6-amino-5-chloro-N-propylpyridine-3-carboxamide (CID 62156037) is 6-amino-5-chloro-N-propylpyridine-3-carboxamide.
What is the SMILES notation for 6-amino-5-chloro-N-propylpyridine-3-carboxamide?
The canonical SMILES for 6-amino-5-chloro-N-propylpyridine-3-carboxamide is CCCNC(=O)c1cnc(N)c(Cl)c1.
What is the InChIKey of 6-amino-5-chloro-N-propylpyridine-3-carboxamide?
The InChIKey is RVKXPMHEZMAVJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12ClN3O/c1-2-3-12-9(14)6-4-7(10)8(11)13-5-6/h4-5H,2-3H2,1H3,(H2,11,13)(H,12,14).
What are the key properties of 6-amino-5-chloro-N-propylpyridine-3-carboxamide?
6-amino-5-chloro-N-propylpyridine-3-carboxamide has a molecular weight of 213.67 g/mol, XLogP of 1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-chloro-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 62156037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).