3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one

C10H9ClN2O — CID 102941601

IUPAC3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one
SMILESCc1cc2c(=O)c(Cl)c[nH]c2c(C)n1
InChIInChI=1S/C10H9ClN2O/c1-5-3-7-9(6(2)13-5)12-4-8(11)10(7)14/h3-4H,1-2H3,(H,12,14)
InChIKeyWHJHIWVDJVNTLA-UHFFFAOYSA-N
MW208.65 g/mol
LogP2.19
Rot. Bonds

About 3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one

3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one (PubChem CID 102941601) has the molecular formula C10H9ClN2O and a molecular weight of 208.65 g/mol. Its IUPAC name is 3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one.

Molecular Properties

Compound Name3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one
PubChem CID102941601
Molecular FormulaC10H9ClN2O
Molecular Weight208.65 g/mol
Exact Mass208.04
IUPAC Name3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one
SMILESCc1cc2c(=O)c(Cl)c[nH]c2c(C)n1
InChIInChI=1S/C10H9ClN2O/c1-5-3-7-9(6(2)13-5)12-4-8(11)10(7)14/h3-4H,1-2H3,(H,12,14)
InChIKeyWHJHIWVDJVNTLA-UHFFFAOYSA-N
XLogP2.19
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.65
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-iodo-6,8-dimethyl-1H-1,7-naphthyridin-4-one
CID 102941603
3-bromo-5,7-dimethyl-1H-pyrrolo[2,3-c]pyridine
CID 123135106
3-chloro-6-fluoro-8-methoxy-1H-quinolin-4-one
CID 114759440
6,8-dimethyl-3H-pyrido[3,4-d]pyrimidin-4-one
CID 135783855
6-bromo-3-chloro-5-fluoro-8-methyl-1H-quinolin-4-one
CID 114759607
5-chloro-3-hydroxy-2-methyl-1H-pyridin-4-one
CID 170218770
3-iodo-8-methyl-1H-1,7-naphthyridin-4-one
CID 102941594
5-chloro-4-methyl-1H-pyridin-2-one
CID 46739797
3-chloro-6-fluoro-1H-quinolin-4-one
CID 45118012
1-(4-chloro-6-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone
CID 130062799
3,6,7,8-tetramethyl-1H-quinolin-4-one
CID 20587758
8-chloro-3-iodo-5-methyl-1H-quinolin-4-one
CID 107627877

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one?
The IUPAC name of 3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one (CID 102941601) is 3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one.
What is the SMILES notation for 3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one?
The canonical SMILES for 3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one is Cc1cc2c(=O)c(Cl)c[nH]c2c(C)n1.
What is the InChIKey of 3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one?
The InChIKey is WHJHIWVDJVNTLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O/c1-5-3-7-9(6(2)13-5)12-4-8(11)10(7)14/h3-4H,1-2H3,(H,12,14).
What are the key properties of 3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one?
3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one has a molecular weight of 208.65 g/mol, XLogP of 2.19, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6,8-dimethyl-1H-1,7-naphthyridin-4-one is sourced from PubChem (CID 102941601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).