2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine

C14H22N2 — CID 167263548

IUPAC2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine
SMILESCC1=C(C)C(C)C2C=NC(C(C)C)CC2=N1
InChIInChI=1S/C14H22N2/c1-8(2)13-6-14-12(7-15-13)10(4)9(3)11(5)16-14/h7-8,10,12-13H,6H2,1-5H3
InChIKeyFGJDPHXNWHTAEY-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.49
Rot. Bonds1

About 2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine

2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine (PubChem CID 167263548) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine.

Molecular Properties

Compound Name2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine
PubChem CID167263548
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine
SMILESCC1=C(C)C(C)C2C=NC(C(C)C)CC2=N1
InChIInChI=1S/C14H22N2/c1-8(2)13-6-14-12(7-15-13)10(4)9(3)11(5)16-14/h7-8,10,12-13H,6H2,1-5H3
InChIKeyFGJDPHXNWHTAEY-UHFFFAOYSA-N
XLogP3.49
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-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 2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine?
The IUPAC name of 2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine (CID 167263548) is 2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine.
What is the SMILES notation for 2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine?
The canonical SMILES for 2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine is CC1=C(C)C(C)C2C=NC(C(C)C)CC2=N1.
What is the InChIKey of 2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine?
The InChIKey is FGJDPHXNWHTAEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-8(2)13-6-14-12(7-15-13)10(4)9(3)11(5)16-14/h7-8,10,12-13H,6H2,1-5H3.
What are the key properties of 2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine?
2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine has a molecular weight of 218.34 g/mol, XLogP of 3.49, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4-trimethyl-7-propan-2-yl-4,4a,7,8-tetrahydro-1,6-naphthyridine is sourced from PubChem (CID 167263548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).