ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine

C15H20N2 — CID 142260601

IUPACethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine
SMILESC=c1cc2cnc(C)cc2n/c1=C/CC.CC
InChIInChI=1S/C13H14N2.C2H6/c1-4-5-12-9(2)6-11-8-14-10(3)7-13(11)15-12;1-2/h5-8H,2,4H2,1,3H3;1-2H3/b12-5+;
InChIKeyMGXQKMDCTRFGSM-NKPNRJPBSA-N
MW228.34 g/mol
LogP2.57
Rot. Bonds1

About ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine

ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine (PubChem CID 142260601) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine.

Molecular Properties

Compound Nameethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine
PubChem CID142260601
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Nameethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine
SMILESC=c1cc2cnc(C)cc2n/c1=C/CC.CC
InChIInChI=1S/C13H14N2.C2H6/c1-4-5-12-9(2)6-11-8-14-10(3)7-13(11)15-12;1-2/h5-8H,2,4H2,1,3H3;1-2H3/b12-5+;
InChIKeyMGXQKMDCTRFGSM-NKPNRJPBSA-N
XLogP2.57
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine?
The IUPAC name of ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine (CID 142260601) is ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine.
What is the SMILES notation for ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine?
The canonical SMILES for ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine is C=c1cc2cnc(C)cc2n/c1=C/CC.CC.
What is the InChIKey of ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine?
The InChIKey is MGXQKMDCTRFGSM-NKPNRJPBSA-N. The full InChI is InChI=1S/C13H14N2.C2H6/c1-4-5-12-9(2)6-11-8-14-10(3)7-13(11)15-12;1-2/h5-8H,2,4H2,1,3H3;1-2H3/b12-5+;.
What are the key properties of ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine?
ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine has a molecular weight of 228.34 g/mol, XLogP of 2.57, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(2E)-7-methyl-3-methylidene-2-propylidene-1,6-naphthyridine is sourced from PubChem (CID 142260601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).