7-methyl-4a,5-dihydro-1,6-naphthyridine

C9H10N2 — CID 123971248

IUPAC7-methyl-4a,5-dihydro-1,6-naphthyridine
SMILESCC1=NCC2C=CC=NC2=C1
InChIInChI=1S/C9H10N2/c1-7-5-9-8(6-11-7)3-2-4-10-9/h2-5,8H,6H2,1H3
InChIKeyZGGRTNRQUKKDJK-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.60
Rot. Bonds

About 7-methyl-4a,5-dihydro-1,6-naphthyridine

7-methyl-4a,5-dihydro-1,6-naphthyridine (PubChem CID 123971248) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 7-methyl-4a,5-dihydro-1,6-naphthyridine.

Molecular Properties

Compound Name7-methyl-4a,5-dihydro-1,6-naphthyridine
PubChem CID123971248
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name7-methyl-4a,5-dihydro-1,6-naphthyridine
SMILESCC1=NCC2C=CC=NC2=C1
InChIInChI=1S/C9H10N2/c1-7-5-9-8(6-11-7)3-2-4-10-9/h2-5,8H,6H2,1H3
InChIKeyZGGRTNRQUKKDJK-UHFFFAOYSA-N
XLogP1.60
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-4a,5-dihydro-1,6-naphthyridine?
The IUPAC name of 7-methyl-4a,5-dihydro-1,6-naphthyridine (CID 123971248) is 7-methyl-4a,5-dihydro-1,6-naphthyridine.
What is the SMILES notation for 7-methyl-4a,5-dihydro-1,6-naphthyridine?
The canonical SMILES for 7-methyl-4a,5-dihydro-1,6-naphthyridine is CC1=NCC2C=CC=NC2=C1.
What is the InChIKey of 7-methyl-4a,5-dihydro-1,6-naphthyridine?
The InChIKey is ZGGRTNRQUKKDJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2/c1-7-5-9-8(6-11-7)3-2-4-10-9/h2-5,8H,6H2,1H3.
What are the key properties of 7-methyl-4a,5-dihydro-1,6-naphthyridine?
7-methyl-4a,5-dihydro-1,6-naphthyridine has a molecular weight of 146.19 g/mol, XLogP of 1.60, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-4a,5-dihydro-1,6-naphthyridine is sourced from PubChem (CID 123971248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).