4-bromo-3-chloro-8-methyl-1,5-naphthyridine

C9H6BrClN2 — CID 103416479

IUPAC4-bromo-3-chloro-8-methyl-1,5-naphthyridine
SMILESCc1ccnc2c(Br)c(Cl)cnc12
InChIInChI=1S/C9H6BrClN2/c1-5-2-3-12-9-7(10)6(11)4-13-8(5)9/h2-4H,1H3
InChIKeyQJVVJNTYPZWDLT-UHFFFAOYSA-N
MW257.52 g/mol
LogP3.35
Rot. Bonds

About 4-bromo-3-chloro-8-methyl-1,5-naphthyridine

4-bromo-3-chloro-8-methyl-1,5-naphthyridine (PubChem CID 103416479) has the molecular formula C9H6BrClN2 and a molecular weight of 257.52 g/mol. Its IUPAC name is 4-bromo-3-chloro-8-methyl-1,5-naphthyridine.

Molecular Properties

Compound Name4-bromo-3-chloro-8-methyl-1,5-naphthyridine
PubChem CID103416479
Molecular FormulaC9H6BrClN2
Molecular Weight257.52 g/mol
Exact Mass255.94
IUPAC Name4-bromo-3-chloro-8-methyl-1,5-naphthyridine
SMILESCc1ccnc2c(Br)c(Cl)cnc12
InChIInChI=1S/C9H6BrClN2/c1-5-2-3-12-9-7(10)6(11)4-13-8(5)9/h2-4H,1H3
InChIKeyQJVVJNTYPZWDLT-UHFFFAOYSA-N
XLogP3.35
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.52
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-3,4-dichloro-8-methylquinoline
CID 114759791
4-bromo-3-chloro-8-methoxy-5-methylquinoline
CID 114763949
4,6-dibromo-3,5-dichloro-8-methylquinoline
CID 164661316
8-chloro-4-methoxy-3-methyl-1,5-naphthyridine
CID 144929643
6,8-dichloro-4-methylquinoline;ethane
CID 177201180
6,8-dichloro-4-methylquinoline;ethane
CID 177201451
8-bromo-7-chloroquinolin-4-amine
CID 103481461
3,8-dimethyl-1,5-naphthyridine
CID 22950376
3,8-dimethylpyrido[2,3-b]pyrazine
CID 144972575
3-bromo-4-chloro-2-methyl-1H-pyrrolo[2,3-b]pyridine
CID 11160927
4,6-dibromo-5-chloro-8-methylquinoline
CID 164661313
2-bromo-5-chloro-4-methylpyridine;ethane
CID 144611479

Frequently Asked Questions

What is the IUPAC name of 4-bromo-3-chloro-8-methyl-1,5-naphthyridine?
The IUPAC name of 4-bromo-3-chloro-8-methyl-1,5-naphthyridine (CID 103416479) is 4-bromo-3-chloro-8-methyl-1,5-naphthyridine.
What is the SMILES notation for 4-bromo-3-chloro-8-methyl-1,5-naphthyridine?
The canonical SMILES for 4-bromo-3-chloro-8-methyl-1,5-naphthyridine is Cc1ccnc2c(Br)c(Cl)cnc12.
What is the InChIKey of 4-bromo-3-chloro-8-methyl-1,5-naphthyridine?
The InChIKey is QJVVJNTYPZWDLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6BrClN2/c1-5-2-3-12-9-7(10)6(11)4-13-8(5)9/h2-4H,1H3.
What are the key properties of 4-bromo-3-chloro-8-methyl-1,5-naphthyridine?
4-bromo-3-chloro-8-methyl-1,5-naphthyridine has a molecular weight of 257.52 g/mol, XLogP of 3.35, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-3-chloro-8-methyl-1,5-naphthyridine is sourced from PubChem (CID 103416479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).