2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine

C13H23N3 — CID 142358580

IUPAC2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine
SMILESCC(C)C1=NC2=C(CC1)CN(CCN)CC2
InChIInChI=1S/C13H23N3/c1-10(2)12-4-3-11-9-16(8-6-14)7-5-13(11)15-12/h10H,3-9,14H2,1-2H3
InChIKeyGAOMQOPZTVNRPS-UHFFFAOYSA-N
MW221.35 g/mol
LogP1.80
Rot. Bonds3

About 2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine

2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine (PubChem CID 142358580) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine.

Molecular Properties

Compound Name2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine
PubChem CID142358580
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine
SMILESCC(C)C1=NC2=C(CC1)CN(CCN)CC2
InChIInChI=1S/C13H23N3/c1-10(2)12-4-3-11-9-16(8-6-14)7-5-13(11)15-12/h10H,3-9,14H2,1-2H3
InChIKeyGAOMQOPZTVNRPS-UHFFFAOYSA-N
XLogP1.80
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine 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-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine?
The IUPAC name of 2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine (CID 142358580) is 2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine.
What is the SMILES notation for 2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine?
The canonical SMILES for 2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine is CC(C)C1=NC2=C(CC1)CN(CCN)CC2.
What is the InChIKey of 2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine?
The InChIKey is GAOMQOPZTVNRPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-10(2)12-4-3-11-9-16(8-6-14)7-5-13(11)15-12/h10H,3-9,14H2,1-2H3.
What are the key properties of 2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine?
2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine has a molecular weight of 221.35 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-yl-4,5,7,8-tetrahydro-3H-1,6-naphthyridin-6-yl)ethanamine is sourced from PubChem (CID 142358580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).