2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine

C17H19N5 — CID 24996161

IUPAC2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine
SMILESCC(C)(N)CNc1nc(-c2ccncc2)cc2cnccc12
InChIInChI=1S/C17H19N5/c1-17(2,18)11-21-16-14-5-8-20-10-13(14)9-15(22-16)12-3-6-19-7-4-12/h3-10H,11,18H2,1-2H3,(H,21,22)
InChIKeyWNDOFCPEDZYDPL-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.84
Rot. Bonds4

About 2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine

2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine (PubChem CID 24996161) has the molecular formula C17H19N5 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine.

Molecular Properties

Compound Name2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine
PubChem CID24996161
Molecular FormulaC17H19N5
Molecular Weight293.37 g/mol
Exact Mass293.16
IUPAC Name2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine
SMILESCC(C)(N)CNc1nc(-c2ccncc2)cc2cnccc12
InChIInChI=1S/C17H19N5/c1-17(2,18)11-21-16-14-5-8-20-10-13(14)9-15(22-16)12-3-6-19-7-4-12/h3-10H,11,18H2,1-2H3,(H,21,22)
InChIKeyWNDOFCPEDZYDPL-UHFFFAOYSA-N
XLogP2.84
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine 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-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine?
The IUPAC name of 2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine (CID 24996161) is 2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine.
What is the SMILES notation for 2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine?
The canonical SMILES for 2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine is CC(C)(N)CNc1nc(-c2ccncc2)cc2cnccc12.
What is the InChIKey of 2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine?
The InChIKey is WNDOFCPEDZYDPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5/c1-17(2,18)11-21-16-14-5-8-20-10-13(14)9-15(22-16)12-3-6-19-7-4-12/h3-10H,11,18H2,1-2H3,(H,21,22).
What are the key properties of 2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine?
2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine has a molecular weight of 293.37 g/mol, XLogP of 2.84, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-N-(3-pyridin-4-yl-2,6-naphthyridin-1-yl)propane-1,2-diamine is sourced from PubChem (CID 24996161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).