7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine

C9H14N2 — CID 86341099

IUPAC7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine
SMILESCC1C=CC2=C(NCCC2)N1
InChIInChI=1S/C9H14N2/c1-7-4-5-8-3-2-6-10-9(8)11-7/h4-5,7,10-11H,2-3,6H2,1H3
InChIKeyASDXNWOUCCGLLV-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.13
Rot. Bonds

About 7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine

7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine (PubChem CID 86341099) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine.

Molecular Properties

Compound Name7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine
PubChem CID86341099
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine
SMILESCC1C=CC2=C(NCCC2)N1
InChIInChI=1S/C9H14N2/c1-7-4-5-8-3-2-6-10-9(8)11-7/h4-5,7,10-11H,2-3,6H2,1H3
InChIKeyASDXNWOUCCGLLV-UHFFFAOYSA-N
XLogP1.13
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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3-Ethyl-1,5,8,8a-tetrahydroquinoline
CID 20077542
1,9a,10,10a-Tetrahydrobenzo[b][1,8]naphthyridine
CID 21568397
1,2,3,4,8,8a-Hexahydro-1,8-naphthyridine
CID 22714282
2,3,4,5-tetrahydro-1H-cyclohepta[d]pyrimidine
CID 67948823
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Frequently Asked Questions

What is the IUPAC name of 7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine?
The IUPAC name of 7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine (CID 86341099) is 7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine.
What is the SMILES notation for 7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine?
The canonical SMILES for 7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine is CC1C=CC2=C(NCCC2)N1.
What is the InChIKey of 7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine?
The InChIKey is ASDXNWOUCCGLLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-7-4-5-8-3-2-6-10-9(8)11-7/h4-5,7,10-11H,2-3,6H2,1H3.
What are the key properties of 7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine?
7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine has a molecular weight of 150.22 g/mol, XLogP of 1.13, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-1,2,3,4,7,8-hexahydro-1,8-naphthyridine is sourced from PubChem (CID 86341099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).