5-amino-8-chloro-6-methyl-1H-quinolin-2-one

C10H9ClN2O — CID 130017028

IUPAC5-amino-8-chloro-6-methyl-1H-quinolin-2-one
SMILESCc1cc(Cl)c2[nH]c(=O)ccc2c1N
InChIInChI=1S/C10H9ClN2O/c1-5-4-7(11)10-6(9(5)12)2-3-8(14)13-10/h2-4H,12H2,1H3,(H,13,14)
InChIKeyHFZFGTNAVRNQEE-UHFFFAOYSA-N
MW208.65 g/mol
LogP2.07
Rot. Bonds

About 5-amino-8-chloro-6-methyl-1H-quinolin-2-one

5-amino-8-chloro-6-methyl-1H-quinolin-2-one (PubChem CID 130017028) has the molecular formula C10H9ClN2O and a molecular weight of 208.65 g/mol. Its IUPAC name is 5-amino-8-chloro-6-methyl-1H-quinolin-2-one.

Molecular Properties

Compound Name5-amino-8-chloro-6-methyl-1H-quinolin-2-one
PubChem CID130017028
Molecular FormulaC10H9ClN2O
Molecular Weight208.65 g/mol
Exact Mass208.04
IUPAC Name5-amino-8-chloro-6-methyl-1H-quinolin-2-one
SMILESCc1cc(Cl)c2[nH]c(=O)ccc2c1N
InChIInChI=1S/C10H9ClN2O/c1-5-4-7(11)10-6(9(5)12)2-3-8(14)13-10/h2-4H,12H2,1H3,(H,13,14)
InChIKeyHFZFGTNAVRNQEE-UHFFFAOYSA-N
XLogP2.07
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.65
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-amino-6-methyl-1H-quinolin-2-one
CID 22226614
5,6,7,8-tetrachloro-1H-quinolin-2-one
CID 141287332
6-chloro-5-methoxy-1H-quinolin-2-one
CID 59141010
5-chloro-6-methyl-1H-pyridin-2-one
CID 23318261
7-chloro-5-methyl-1H-1,8-naphthyridin-2-one
CID 21073917
4-amino-6-chloro-3-methyl-2H-isoquinolin-1-one
CID 84676451
6-(aminomethyl)-8-chloro-1H-quinolin-2-one
CID 82507717
4-amino-8-methyl-1H-quinolin-2-one
CID 14627645
8-chloro-6-iodo-2-methyl-1H-quinolin-4-one
CID 107607566
1,8-dichloro-3,6-dimethyl-9H-carbazole
CID 156769034
5-chloro-6-methoxy-1H-pyridin-2-one
CID 118989149
8-chloro-4-hydroxy-5-methyl-1H-quinolin-2-one
CID 164656985

Frequently Asked Questions

What is the IUPAC name of 5-amino-8-chloro-6-methyl-1H-quinolin-2-one?
The IUPAC name of 5-amino-8-chloro-6-methyl-1H-quinolin-2-one (CID 130017028) is 5-amino-8-chloro-6-methyl-1H-quinolin-2-one.
What is the SMILES notation for 5-amino-8-chloro-6-methyl-1H-quinolin-2-one?
The canonical SMILES for 5-amino-8-chloro-6-methyl-1H-quinolin-2-one is Cc1cc(Cl)c2[nH]c(=O)ccc2c1N.
What is the InChIKey of 5-amino-8-chloro-6-methyl-1H-quinolin-2-one?
The InChIKey is HFZFGTNAVRNQEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O/c1-5-4-7(11)10-6(9(5)12)2-3-8(14)13-10/h2-4H,12H2,1H3,(H,13,14).
What are the key properties of 5-amino-8-chloro-6-methyl-1H-quinolin-2-one?
5-amino-8-chloro-6-methyl-1H-quinolin-2-one has a molecular weight of 208.65 g/mol, XLogP of 2.07, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-8-chloro-6-methyl-1H-quinolin-2-one is sourced from PubChem (CID 130017028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).