N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine

C17H18N6 — CID 171795758

IUPACN-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine
SMILESc1cc2nc(Nc3cc(N4CCNCC4)ccn3)ccc2cn1
InChIInChI=1S/C17H18N6/c1-2-16(21-15-4-5-19-12-13(1)15)22-17-11-14(3-6-20-17)23-9-7-18-8-10-23/h1-6,11-12,18H,7-10H2,(H,20,21,22)
InChIKeyXHJLMYAFQMWNEK-UHFFFAOYSA-N
MW306.37 g/mol
LogP2.18
Rot. Bonds3

About N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine

N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine (PubChem CID 171795758) has the molecular formula C17H18N6 and a molecular weight of 306.37 g/mol. Its IUPAC name is N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine.

Molecular Properties

Compound NameN-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine
PubChem CID171795758
Molecular FormulaC17H18N6
Molecular Weight306.37 g/mol
Exact Mass306.16
IUPAC NameN-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine
SMILESc1cc2nc(Nc3cc(N4CCNCC4)ccn3)ccc2cn1
InChIInChI=1S/C17H18N6/c1-2-16(21-15-4-5-19-12-13(1)15)22-17-11-14(3-6-20-17)23-9-7-18-8-10-23/h1-6,11-12,18H,7-10H2,(H,20,21,22)
InChIKeyXHJLMYAFQMWNEK-UHFFFAOYSA-N
XLogP2.18
TPSA65.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-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 N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine?
The IUPAC name of N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine (CID 171795758) is N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine.
What is the SMILES notation for N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine?
The canonical SMILES for N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine is c1cc2nc(Nc3cc(N4CCNCC4)ccn3)ccc2cn1.
What is the InChIKey of N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine?
The InChIKey is XHJLMYAFQMWNEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N6/c1-2-16(21-15-4-5-19-12-13(1)15)22-17-11-14(3-6-20-17)23-9-7-18-8-10-23/h1-6,11-12,18H,7-10H2,(H,20,21,22).
What are the key properties of N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine?
N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine has a molecular weight of 306.37 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-piperazin-1-yl-2-pyridinyl)-1,6-naphthyridin-2-amine is sourced from PubChem (CID 171795758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).