2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine

C17H27N5 — CID 12018530

IUPAC2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine
SMILESCCCCc1nc2c(N)nc3c(c2n1CC(C)C)CCNC3
InChIInChI=1S/C17H27N5/c1-4-5-6-14-21-15-16(22(14)10-11(2)3)12-7-8-19-9-13(12)20-17(15)18/h11,19H,4-10H2,1-3H3,(H2,18,20)
InChIKeyJPRWNUUKSJXRRK-UHFFFAOYSA-N
MW301.44 g/mol
LogP2.66
Rot. Bonds5

About 2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine

2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine (PubChem CID 12018530) has the molecular formula C17H27N5 and a molecular weight of 301.44 g/mol. Its IUPAC name is 2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine.

Molecular Properties

Compound Name2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine
PubChem CID12018530
Molecular FormulaC17H27N5
Molecular Weight301.44 g/mol
Exact Mass301.23
IUPAC Name2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine
SMILESCCCCc1nc2c(N)nc3c(c2n1CC(C)C)CCNC3
InChIInChI=1S/C17H27N5/c1-4-5-6-14-21-15-16(22(14)10-11(2)3)12-7-8-19-9-13(12)20-17(15)18/h11,19H,4-10H2,1-3H3,(H2,18,20)
InChIKeyJPRWNUUKSJXRRK-UHFFFAOYSA-N
XLogP2.66
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.44
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine 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-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine?
The IUPAC name of 2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine (CID 12018530) is 2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine.
What is the SMILES notation for 2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine?
The canonical SMILES for 2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine is CCCCc1nc2c(N)nc3c(c2n1CC(C)C)CCNC3.
What is the InChIKey of 2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine?
The InChIKey is JPRWNUUKSJXRRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N5/c1-4-5-6-14-21-15-16(22(14)10-11(2)3)12-7-8-19-9-13(12)20-17(15)18/h11,19H,4-10H2,1-3H3,(H2,18,20).
What are the key properties of 2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine?
2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine has a molecular weight of 301.44 g/mol, XLogP of 2.66, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-1-(2-methylpropyl)-6,7,8,9-tetrahydroimidazo[4,5-c][1,7]naphthyridin-4-amine is sourced from PubChem (CID 12018530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).