8-methyl-1,6-naphthyridine-3-carbonitrile

C10H7N3 — CID 55295879

IUPAC8-methyl-1,6-naphthyridine-3-carbonitrile
SMILESCc1cncc2cc(C#N)cnc12
InChIInChI=1S/C10H7N3/c1-7-4-12-6-9-2-8(3-11)5-13-10(7)9/h2,4-6H,1H3
InChIKeyOYGCTKHDQQKNOJ-UHFFFAOYSA-N
MW169.19 g/mol
LogP1.81
Rot. Bonds

About 8-methyl-1,6-naphthyridine-3-carbonitrile

8-methyl-1,6-naphthyridine-3-carbonitrile (PubChem CID 55295879) has the molecular formula C10H7N3 and a molecular weight of 169.19 g/mol. Its IUPAC name is 8-methyl-1,6-naphthyridine-3-carbonitrile.

Molecular Properties

Compound Name8-methyl-1,6-naphthyridine-3-carbonitrile
PubChem CID55295879
Molecular FormulaC10H7N3
Molecular Weight169.19 g/mol
Exact Mass169.06
IUPAC Name8-methyl-1,6-naphthyridine-3-carbonitrile
SMILESCc1cncc2cc(C#N)cnc12
InChIInChI=1S/C10H7N3/c1-7-4-12-6-9-2-8(3-11)5-13-10(7)9/h2,4-6H,1H3
InChIKeyOYGCTKHDQQKNOJ-UHFFFAOYSA-N
XLogP1.81
TPSA49.57 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.19
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-1,6-naphthyridine-3-carbonitrile?
The IUPAC name of 8-methyl-1,6-naphthyridine-3-carbonitrile (CID 55295879) is 8-methyl-1,6-naphthyridine-3-carbonitrile.
What is the SMILES notation for 8-methyl-1,6-naphthyridine-3-carbonitrile?
The canonical SMILES for 8-methyl-1,6-naphthyridine-3-carbonitrile is Cc1cncc2cc(C#N)cnc12.
What is the InChIKey of 8-methyl-1,6-naphthyridine-3-carbonitrile?
The InChIKey is OYGCTKHDQQKNOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3/c1-7-4-12-6-9-2-8(3-11)5-13-10(7)9/h2,4-6H,1H3.
What are the key properties of 8-methyl-1,6-naphthyridine-3-carbonitrile?
8-methyl-1,6-naphthyridine-3-carbonitrile has a molecular weight of 169.19 g/mol, XLogP of 1.81, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-1,6-naphthyridine-3-carbonitrile is sourced from PubChem (CID 55295879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).