2-pyridin-3-ylpyrimidine

C9H7N3 — CID 13349629

IUPAC2-pyridin-3-ylpyrimidine
SMILESc1cnc(-c2cccnc2)nc1
InChIInChI=1S/C9H7N3/c1-3-8(7-10-4-1)9-11-5-2-6-12-9/h1-7H
InChIKeyDYEAIDZAOQKZJM-UHFFFAOYSA-N
MW157.18 g/mol
LogP1.54
Rot. Bonds1

About 2-pyridin-3-ylpyrimidine

2-pyridin-3-ylpyrimidine (PubChem CID 13349629) has the molecular formula C9H7N3 and a molecular weight of 157.18 g/mol. Its IUPAC name is 2-pyridin-3-ylpyrimidine.

Molecular Properties

Compound Name2-pyridin-3-ylpyrimidine
PubChem CID13349629
Molecular FormulaC9H7N3
Molecular Weight157.18 g/mol
Exact Mass157.06
IUPAC Name2-pyridin-3-ylpyrimidine
SMILESc1cnc(-c2cccnc2)nc1
InChIInChI=1S/C9H7N3/c1-3-8(7-10-4-1)9-11-5-2-6-12-9/h1-7H
InChIKeyDYEAIDZAOQKZJM-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 2-pyridin-3-ylpyrimidine?
The IUPAC name of 2-pyridin-3-ylpyrimidine (CID 13349629) is 2-pyridin-3-ylpyrimidine.
What is the SMILES notation for 2-pyridin-3-ylpyrimidine?
The canonical SMILES for 2-pyridin-3-ylpyrimidine is c1cnc(-c2cccnc2)nc1.
What is the InChIKey of 2-pyridin-3-ylpyrimidine?
The InChIKey is DYEAIDZAOQKZJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N3/c1-3-8(7-10-4-1)9-11-5-2-6-12-9/h1-7H.
What are the key properties of 2-pyridin-3-ylpyrimidine?
2-pyridin-3-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 2-pyridin-3-ylpyrimidine is sourced from PubChem (CID 13349629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).