2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine

C10H12N2 — CID 91024706

IUPAC2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine
SMILESC=c1cc2c(nc1=C)CCNC2
InChIInChI=1S/C10H12N2/c1-7-5-9-6-11-4-3-10(9)12-8(7)2/h5,11H,1-4,6H2
InChIKeyMNCQFDMQMSTPHI-UHFFFAOYSA-N
MW160.22 g/mol
LogP-0.45
Rot. Bonds

About 2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine

2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine (PubChem CID 91024706) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine.

Molecular Properties

Compound Name2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine
PubChem CID91024706
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine
SMILESC=c1cc2c(nc1=C)CCNC2
InChIInChI=1S/C10H12N2/c1-7-5-9-6-11-4-3-10(9)12-8(7)2/h5,11H,1-4,6H2
InChIKeyMNCQFDMQMSTPHI-UHFFFAOYSA-N
XLogP-0.45
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 5-0.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 163489310
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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine?
The IUPAC name of 2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine (CID 91024706) is 2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine.
What is the SMILES notation for 2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine?
The canonical SMILES for 2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine is C=c1cc2c(nc1=C)CCNC2.
What is the InChIKey of 2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine?
The InChIKey is MNCQFDMQMSTPHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-7-5-9-6-11-4-3-10(9)12-8(7)2/h5,11H,1-4,6H2.
What are the key properties of 2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine?
2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine has a molecular weight of 160.22 g/mol, XLogP of -0.45, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylidene-5,6,7,8-tetrahydro-1,6-naphthyridine is sourced from PubChem (CID 91024706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).