2-amino-5-chloro-N-methylpyridine-4-carboxamide

C7H8ClN3O — CID 114921748

IUPAC2-amino-5-chloro-N-methylpyridine-4-carboxamide
SMILESCNC(=O)c1cc(N)ncc1Cl
InChIInChI=1S/C7H8ClN3O/c1-10-7(12)4-2-6(9)11-3-5(4)8/h2-3H,1H3,(H2,9,11)(H,10,12)
InChIKeyUGVODHJUOVPJJY-UHFFFAOYSA-N
MW185.61 g/mol
LogP0.68
Rot. Bonds1

About 2-amino-5-chloro-N-methylpyridine-4-carboxamide

2-amino-5-chloro-N-methylpyridine-4-carboxamide (PubChem CID 114921748) has the molecular formula C7H8ClN3O and a molecular weight of 185.61 g/mol. Its IUPAC name is 2-amino-5-chloro-N-methylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-chloro-N-methylpyridine-4-carboxamide
PubChem CID114921748
Molecular FormulaC7H8ClN3O
Molecular Weight185.61 g/mol
Exact Mass185.04
IUPAC Name2-amino-5-chloro-N-methylpyridine-4-carboxamide
SMILESCNC(=O)c1cc(N)ncc1Cl
InChIInChI=1S/C7H8ClN3O/c1-10-7(12)4-2-6(9)11-3-5(4)8/h2-3H,1H3,(H2,9,11)(H,10,12)
InChIKeyUGVODHJUOVPJJY-UHFFFAOYSA-N
XLogP0.68
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.61
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-5-chloro-N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide
CID 114922239
2-amino-5-chloro-N-(2-methylpropyl)pyridine-4-carboxamide
CID 114921737
2-amino-5-chloro-N-(2-methylbutan-2-yl)pyridine-4-carboxamide
CID 114921690
2-amino-N-butan-2-yl-5-chloropyridine-4-carboxamide
CID 114921730
6-amino-N,4-dimethylpyridine-3-carboxamide
CID 131967585
2-amino-5-chloro-N-pyrimidin-5-ylpyridine-4-carboxamide
CID 107589913
2-amino-5-chloro-N-(4-methylpentan-2-yl)pyridine-4-carboxamide
CID 114922209
2-amino-5-chloro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridine-4-carboxamide
CID 114922785
2-amino-5-chloro-N-[(6-methyl-3-pyridinyl)methyl]pyridine-4-carboxamide
CID 114923423
2-amino-5-chloro-N-octylpyridine-4-carboxamide
CID 114924255
2-amino-5-chloro-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyridine-4-carboxamide
CID 114923513
2-amino-5-chloro-N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide
CID 106377371

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N-methylpyridine-4-carboxamide?
The IUPAC name of 2-amino-5-chloro-N-methylpyridine-4-carboxamide (CID 114921748) is 2-amino-5-chloro-N-methylpyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-chloro-N-methylpyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-chloro-N-methylpyridine-4-carboxamide is CNC(=O)c1cc(N)ncc1Cl.
What is the InChIKey of 2-amino-5-chloro-N-methylpyridine-4-carboxamide?
The InChIKey is UGVODHJUOVPJJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClN3O/c1-10-7(12)4-2-6(9)11-3-5(4)8/h2-3H,1H3,(H2,9,11)(H,10,12).
What are the key properties of 2-amino-5-chloro-N-methylpyridine-4-carboxamide?
2-amino-5-chloro-N-methylpyridine-4-carboxamide has a molecular weight of 185.61 g/mol, XLogP of 0.68, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-chloro-N-methylpyridine-4-carboxamide is sourced from PubChem (CID 114921748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).