7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine

C17H15ClN2O2 — CID 142754785

IUPAC7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine
SMILESCOc1cc(OC)cc(-c2cc3cnc(Cl)cc3c(C)n2)c1
InChIInChI=1S/C17H15ClN2O2/c1-10-15-8-17(18)19-9-12(15)6-16(20-10)11-4-13(21-2)7-14(5-11)22-3/h4-9H,1-3H3
InChIKeyJMAVIRKAJOZIQN-UHFFFAOYSA-N
MW314.77 g/mol
LogP4.28
Rot. Bonds3

About 7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine

7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine (PubChem CID 142754785) has the molecular formula C17H15ClN2O2 and a molecular weight of 314.77 g/mol. Its IUPAC name is 7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine.

Molecular Properties

Compound Name7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine
PubChem CID142754785
Molecular FormulaC17H15ClN2O2
Molecular Weight314.77 g/mol
Exact Mass314.08
IUPAC Name7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine
SMILESCOc1cc(OC)cc(-c2cc3cnc(Cl)cc3c(C)n2)c1
InChIInChI=1S/C17H15ClN2O2/c1-10-15-8-17(18)19-9-12(15)6-16(20-10)11-4-13(21-2)7-14(5-11)22-3/h4-9H,1-3H3
InChIKeyJMAVIRKAJOZIQN-UHFFFAOYSA-N
XLogP4.28
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.77
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

7-chloro-3-(3,5-dimethoxyphenyl)-2H-2,6-naphthyridin-1-one;ethane
CID 142381159
7-chloro-3-(3,5-dimethoxyphenyl)-2-methyl-2,6-naphthyridin-1-one
CID 135180205
2,4-dichloro-6-(3,5-dimethoxyphenyl)pyrido[3,4-d]pyrimidine
CID 135181348
3-chloro-7-methoxyisoquinoline
CID 53425565
3-chloro-6-methoxyisoquinoline
CID 53407774
3-(3,5-dimethoxyphenyl)-6-fluoroisoquinoline
CID 25058376
3-(3,4-dichlorophenyl)-6,7-dimethoxy-1-methylisoquinoline
CID 25165022
2,8-dichloro-6-(3,5-dimethoxyphenyl)quinazoline
CID 118036174
7-chloro-1-methoxypyrido[3,4-d]pyridazine
CID 156527015
6-(3,5-dimethoxyphenyl)-8-fluoro-2-methylquinazoline
CID 123452237
2-chloro-6-(3,5-dimethoxyphenyl)pyrido[3,4-d]pyrimidin-4-amine;2,4-dichloro-6-(3,5-dimethoxyphenyl)pyrido[3,4-d]pyrimidine
CID 162028964
2-(3,5-dimethoxyphenyl)quinoxaline
CID 102112241

Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine?
The IUPAC name of 7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine (CID 142754785) is 7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine.
What is the SMILES notation for 7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine?
The canonical SMILES for 7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine is COc1cc(OC)cc(-c2cc3cnc(Cl)cc3c(C)n2)c1.
What is the InChIKey of 7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine?
The InChIKey is JMAVIRKAJOZIQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2O2/c1-10-15-8-17(18)19-9-12(15)6-16(20-10)11-4-13(21-2)7-14(5-11)22-3/h4-9H,1-3H3.
What are the key properties of 7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine?
7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine has a molecular weight of 314.77 g/mol, XLogP of 4.28, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-(3,5-dimethoxyphenyl)-1-methyl-2,6-naphthyridine is sourced from PubChem (CID 142754785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).