2-pyrimidin-2-yl-1,7-naphthyridin-8-amine

C12H9N5 — CID 23467675

IUPAC2-pyrimidin-2-yl-1,7-naphthyridin-8-amine
SMILESNc1nccc2ccc(-c3ncccn3)nc12
InChIInChI=1S/C12H9N5/c13-11-10-8(4-7-14-11)2-3-9(17-10)12-15-5-1-6-16-12/h1-7H,(H2,13,14)
InChIKeyAVGJGMHNPZPQCD-UHFFFAOYSA-N
MW223.24 g/mol
LogP1.67
Rot. Bonds1

About 2-pyrimidin-2-yl-1,7-naphthyridin-8-amine

2-pyrimidin-2-yl-1,7-naphthyridin-8-amine (PubChem CID 23467675) has the molecular formula C12H9N5 and a molecular weight of 223.24 g/mol. Its IUPAC name is 2-pyrimidin-2-yl-1,7-naphthyridin-8-amine.

Molecular Properties

Compound Name2-pyrimidin-2-yl-1,7-naphthyridin-8-amine
PubChem CID23467675
Molecular FormulaC12H9N5
Molecular Weight223.24 g/mol
Exact Mass223.09
IUPAC Name2-pyrimidin-2-yl-1,7-naphthyridin-8-amine
SMILESNc1nccc2ccc(-c3ncccn3)nc12
InChIInChI=1S/C12H9N5/c13-11-10-8(4-7-14-11)2-3-9(17-10)12-15-5-1-6-16-12/h1-7H,(H2,13,14)
InChIKeyAVGJGMHNPZPQCD-UHFFFAOYSA-N
XLogP1.67
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-pyrimidin-2-yl-1,7-naphthyridin-8-amine?
The IUPAC name of 2-pyrimidin-2-yl-1,7-naphthyridin-8-amine (CID 23467675) is 2-pyrimidin-2-yl-1,7-naphthyridin-8-amine.
What is the SMILES notation for 2-pyrimidin-2-yl-1,7-naphthyridin-8-amine?
The canonical SMILES for 2-pyrimidin-2-yl-1,7-naphthyridin-8-amine is Nc1nccc2ccc(-c3ncccn3)nc12.
What is the InChIKey of 2-pyrimidin-2-yl-1,7-naphthyridin-8-amine?
The InChIKey is AVGJGMHNPZPQCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N5/c13-11-10-8(4-7-14-11)2-3-9(17-10)12-15-5-1-6-16-12/h1-7H,(H2,13,14).
What are the key properties of 2-pyrimidin-2-yl-1,7-naphthyridin-8-amine?
2-pyrimidin-2-yl-1,7-naphthyridin-8-amine has a molecular weight of 223.24 g/mol, XLogP of 1.67, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrimidin-2-yl-1,7-naphthyridin-8-amine is sourced from PubChem (CID 23467675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).