4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine

C18H19N5 — CID 137350730

IUPAC4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine
SMILESCC1CNCCN1c1cc(-c2ccncc2)nc2cnccc12
InChIInChI=1S/C18H19N5/c1-13-11-21-8-9-23(13)18-10-16(14-2-5-19-6-3-14)22-17-12-20-7-4-15(17)18/h2-7,10,12-13,21H,8-9,11H2,1H3
InChIKeyDINNXJLXOCEBGU-UHFFFAOYSA-N
MW305.38 g/mol
LogP2.49
Rot. Bonds2

About 4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine

4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine (PubChem CID 137350730) has the molecular formula C18H19N5 and a molecular weight of 305.38 g/mol. Its IUPAC name is 4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine.

Molecular Properties

Compound Name4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine
PubChem CID137350730
Molecular FormulaC18H19N5
Molecular Weight305.38 g/mol
Exact Mass305.16
IUPAC Name4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine
SMILESCC1CNCCN1c1cc(-c2ccncc2)nc2cnccc12
InChIInChI=1S/C18H19N5/c1-13-11-21-8-9-23(13)18-10-16(14-2-5-19-6-3-14)22-17-12-20-7-4-15(17)18/h2-7,10,12-13,21H,8-9,11H2,1H3
InChIKeyDINNXJLXOCEBGU-UHFFFAOYSA-N
XLogP2.49
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-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 4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine?
The IUPAC name of 4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine (CID 137350730) is 4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine.
What is the SMILES notation for 4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine?
The canonical SMILES for 4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine is CC1CNCCN1c1cc(-c2ccncc2)nc2cnccc12.
What is the InChIKey of 4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine?
The InChIKey is DINNXJLXOCEBGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5/c1-13-11-21-8-9-23(13)18-10-16(14-2-5-19-6-3-14)22-17-12-20-7-4-15(17)18/h2-7,10,12-13,21H,8-9,11H2,1H3.
What are the key properties of 4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine?
4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine has a molecular weight of 305.38 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpiperazin-1-yl)-2-pyridin-4-yl-1,7-naphthyridine is sourced from PubChem (CID 137350730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).