5-pyridin-2-ylpyrimidine

C9H7N3 — CID 11126521

IUPAC5-pyridin-2-ylpyrimidine
SMILESc1ccc(-c2cncnc2)nc1
InChIInChI=1S/C9H7N3/c1-2-4-12-9(3-1)8-5-10-7-11-6-8/h1-7H
InChIKeyNRGNZMZNCZZXII-UHFFFAOYSA-N
MW157.18 g/mol
LogP1.54
Rot. Bonds1

About 5-pyridin-2-ylpyrimidine

5-pyridin-2-ylpyrimidine (PubChem CID 11126521) has the molecular formula C9H7N3 and a molecular weight of 157.18 g/mol. Its IUPAC name is 5-pyridin-2-ylpyrimidine.

Molecular Properties

Compound Name5-pyridin-2-ylpyrimidine
PubChem CID11126521
Molecular FormulaC9H7N3
Molecular Weight157.18 g/mol
Exact Mass157.06
IUPAC Name5-pyridin-2-ylpyrimidine
SMILESc1ccc(-c2cncnc2)nc1
InChIInChI=1S/C9H7N3/c1-2-4-12-9(3-1)8-5-10-7-11-6-8/h1-7H
InChIKeyNRGNZMZNCZZXII-UHFFFAOYSA-N
XLogP1.54
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.18
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-pyridin-2-ylpyrimidine?
The IUPAC name of 5-pyridin-2-ylpyrimidine (CID 11126521) is 5-pyridin-2-ylpyrimidine.
What is the SMILES notation for 5-pyridin-2-ylpyrimidine?
The canonical SMILES for 5-pyridin-2-ylpyrimidine is c1ccc(-c2cncnc2)nc1.
What is the InChIKey of 5-pyridin-2-ylpyrimidine?
The InChIKey is NRGNZMZNCZZXII-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N3/c1-2-4-12-9(3-1)8-5-10-7-11-6-8/h1-7H.
What are the key properties of 5-pyridin-2-ylpyrimidine?
5-pyridin-2-ylpyrimidine has a molecular weight of 157.18 g/mol, XLogP of 1.54, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-2-ylpyrimidine is sourced from PubChem (CID 11126521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).