10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine

C13H16N2 — CID 20760292

IUPAC10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine
SMILESCN1C2=C(CCCC2)Cc2cccnc21
InChIInChI=1S/C13H16N2/c1-15-12-7-3-2-5-10(12)9-11-6-4-8-14-13(11)15/h4,6,8H,2-3,5,7,9H2,1H3
InChIKeyKWJCNQXADQYRFX-UHFFFAOYSA-N
MW200.29 g/mol
LogP2.90
Rot. Bonds

About 10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine

10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine (PubChem CID 20760292) has the molecular formula C13H16N2 and a molecular weight of 200.29 g/mol. Its IUPAC name is 10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine.

Molecular Properties

Compound Name10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine
PubChem CID20760292
Molecular FormulaC13H16N2
Molecular Weight200.29 g/mol
Exact Mass200.13
IUPAC Name10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine
SMILESCN1C2=C(CCCC2)Cc2cccnc21
InChIInChI=1S/C13H16N2/c1-15-12-7-3-2-5-10(12)9-11-6-4-8-14-13(11)15/h4,6,8H,2-3,5,7,9H2,1H3
InChIKeyKWJCNQXADQYRFX-UHFFFAOYSA-N
XLogP2.90
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.29
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine?
The IUPAC name of 10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine (CID 20760292) is 10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine.
What is the SMILES notation for 10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine?
The canonical SMILES for 10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine is CN1C2=C(CCCC2)Cc2cccnc21.
What is the InChIKey of 10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine?
The InChIKey is KWJCNQXADQYRFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2/c1-15-12-7-3-2-5-10(12)9-11-6-4-8-14-13(11)15/h4,6,8H,2-3,5,7,9H2,1H3.
What are the key properties of 10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine?
10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine has a molecular weight of 200.29 g/mol, XLogP of 2.90, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-6,7,8,9-tetrahydro-5H-benzo[b][1,8]naphthyridine is sourced from PubChem (CID 20760292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).