3-amino-5-chloro-1-methylpyridin-2-one

C6H7ClN2O — CID 86703118

IUPAC3-amino-5-chloro-1-methylpyridin-2-one
SMILESCn1cc(Cl)cc(N)c1=O
InChIInChI=1S/C6H7ClN2O/c1-9-3-4(7)2-5(8)6(9)10/h2-3H,8H2,1H3
InChIKeyHTAAYUPTIQIFCP-UHFFFAOYSA-N
MW158.59 g/mol
LogP0.62
Rot. Bonds

About 3-amino-5-chloro-1-methylpyridin-2-one

3-amino-5-chloro-1-methylpyridin-2-one (PubChem CID 86703118) has the molecular formula C6H7ClN2O and a molecular weight of 158.59 g/mol. Its IUPAC name is 3-amino-5-chloro-1-methylpyridin-2-one.

Molecular Properties

Compound Name3-amino-5-chloro-1-methylpyridin-2-one
PubChem CID86703118
Molecular FormulaC6H7ClN2O
Molecular Weight158.59 g/mol
Exact Mass158.02
IUPAC Name3-amino-5-chloro-1-methylpyridin-2-one
SMILESCn1cc(Cl)cc(N)c1=O
InChIInChI=1S/C6H7ClN2O/c1-9-3-4(7)2-5(8)6(9)10/h2-3H,8H2,1H3
InChIKeyHTAAYUPTIQIFCP-UHFFFAOYSA-N
XLogP0.62
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.59
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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3-Amino-5-chloro-2-hydroxypyridine
CID 21560644
3-Amino-1-ethyl-1,2-dihydropyridin-2-one
CID 18718035
5-Amino-3-chloro-1-methyl-1,2-dihydropyridin-2-one
CID 71756073
5-Amino-1-methyl-1,2-dihydropyridin-2-one hydrochloride
CID 45791605
3-Aminopyridin-2-ol hydrochloride
CID 47002579
3-Amino-1,6-dimethyl-1,2-dihydropyridin-2-one
CID 71695441
1-Methyl-3-(methylamino)-1,2-dihydropyridin-2-one hydrochloride
CID 154848949
3-Amino-5-bromo-1-methyl-1,2-dihydropyridin-2-one hydrochloride
CID 165985568
3-(Dimethylamino)-2-oxo-1,2-dihydropyridine
CID 14511042

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-chloro-1-methylpyridin-2-one?
The IUPAC name of 3-amino-5-chloro-1-methylpyridin-2-one (CID 86703118) is 3-amino-5-chloro-1-methylpyridin-2-one.
What is the SMILES notation for 3-amino-5-chloro-1-methylpyridin-2-one?
The canonical SMILES for 3-amino-5-chloro-1-methylpyridin-2-one is Cn1cc(Cl)cc(N)c1=O.
What is the InChIKey of 3-amino-5-chloro-1-methylpyridin-2-one?
The InChIKey is HTAAYUPTIQIFCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN2O/c1-9-3-4(7)2-5(8)6(9)10/h2-3H,8H2,1H3.
What are the key properties of 3-amino-5-chloro-1-methylpyridin-2-one?
3-amino-5-chloro-1-methylpyridin-2-one has a molecular weight of 158.59 g/mol, XLogP of 0.62, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-chloro-1-methylpyridin-2-one is sourced from PubChem (CID 86703118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).