5-pyridin-2-ylpyrimidin-2-amine

C9H8N4 — CID 24745735

IUPAC5-pyridin-2-ylpyrimidin-2-amine
SMILESNc1ncc(-c2ccccn2)cn1
InChIInChI=1S/C9H8N4/c10-9-12-5-7(6-13-9)8-3-1-2-4-11-8/h1-6H,(H2,10,12,13)
InChIKeyIWYRVFRXVODLQJ-UHFFFAOYSA-N
MW172.19 g/mol
LogP1.12
Rot. Bonds1

About 5-pyridin-2-ylpyrimidin-2-amine

5-pyridin-2-ylpyrimidin-2-amine (PubChem CID 24745735) has the molecular formula C9H8N4 and a molecular weight of 172.19 g/mol. Its IUPAC name is 5-pyridin-2-ylpyrimidin-2-amine.

Molecular Properties

Compound Name5-pyridin-2-ylpyrimidin-2-amine
PubChem CID24745735
Molecular FormulaC9H8N4
Molecular Weight172.19 g/mol
Exact Mass172.07
IUPAC Name5-pyridin-2-ylpyrimidin-2-amine
SMILESNc1ncc(-c2ccccn2)cn1
InChIInChI=1S/C9H8N4/c10-9-12-5-7(6-13-9)8-3-1-2-4-11-8/h1-6H,(H2,10,12,13)
InChIKeyIWYRVFRXVODLQJ-UHFFFAOYSA-N
XLogP1.12
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.19
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-pyridin-2-ylpyrimidin-2-amine?
The IUPAC name of 5-pyridin-2-ylpyrimidin-2-amine (CID 24745735) is 5-pyridin-2-ylpyrimidin-2-amine.
What is the SMILES notation for 5-pyridin-2-ylpyrimidin-2-amine?
The canonical SMILES for 5-pyridin-2-ylpyrimidin-2-amine is Nc1ncc(-c2ccccn2)cn1.
What is the InChIKey of 5-pyridin-2-ylpyrimidin-2-amine?
The InChIKey is IWYRVFRXVODLQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N4/c10-9-12-5-7(6-13-9)8-3-1-2-4-11-8/h1-6H,(H2,10,12,13).
What are the key properties of 5-pyridin-2-ylpyrimidin-2-amine?
5-pyridin-2-ylpyrimidin-2-amine has a molecular weight of 172.19 g/mol, XLogP of 1.12, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-2-ylpyrimidin-2-amine is sourced from PubChem (CID 24745735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).