4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine

C20H24N6 — CID 67026531

IUPAC4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine
SMILESCC(C)Nc1cc(-c2cc3cnccc3c(N3CCNCC3)n2)ccn1
InChIInChI=1S/C20H24N6/c1-14(2)24-19-12-15(3-6-23-19)18-11-16-13-22-5-4-17(16)20(25-18)26-9-7-21-8-10-26/h3-6,11-14,21H,7-10H2,1-2H3,(H,23,24)
InChIKeySMLRNQKZFYTLJU-UHFFFAOYSA-N
MW348.45 g/mol
LogP2.92
Rot. Bonds4

About 4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine

4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine (PubChem CID 67026531) has the molecular formula C20H24N6 and a molecular weight of 348.45 g/mol. Its IUPAC name is 4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine.

Molecular Properties

Compound Name4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine
PubChem CID67026531
Molecular FormulaC20H24N6
Molecular Weight348.45 g/mol
Exact Mass348.21
IUPAC Name4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine
SMILESCC(C)Nc1cc(-c2cc3cnccc3c(N3CCNCC3)n2)ccn1
InChIInChI=1S/C20H24N6/c1-14(2)24-19-12-15(3-6-23-19)18-11-16-13-22-5-4-17(16)20(25-18)26-9-7-21-8-10-26/h3-6,11-14,21H,7-10H2,1-2H3,(H,23,24)
InChIKeySMLRNQKZFYTLJU-UHFFFAOYSA-N
XLogP2.92
TPSA65.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine?
The IUPAC name of 4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine (CID 67026531) is 4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine.
What is the SMILES notation for 4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine?
The canonical SMILES for 4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine is CC(C)Nc1cc(-c2cc3cnccc3c(N3CCNCC3)n2)ccn1.
What is the InChIKey of 4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine?
The InChIKey is SMLRNQKZFYTLJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6/c1-14(2)24-19-12-15(3-6-23-19)18-11-16-13-22-5-4-17(16)20(25-18)26-9-7-21-8-10-26/h3-6,11-14,21H,7-10H2,1-2H3,(H,23,24).
What are the key properties of 4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine?
4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine has a molecular weight of 348.45 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-piperazin-1-yl-2,6-naphthyridin-3-yl)-N-propan-2-ylpyridin-2-amine is sourced from PubChem (CID 67026531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).