6-pyrazol-1-ylpyrimidin-4-amine

C7H7N5 — CID 10749494

IUPAC6-pyrazol-1-ylpyrimidin-4-amine
SMILESNc1cc(-n2cccn2)ncn1
InChIInChI=1S/C7H7N5/c8-6-4-7(10-5-9-6)12-3-1-2-11-12/h1-5H,(H2,8,9,10)
InChIKeyWAQXCJDLNSZZSS-UHFFFAOYSA-N
MW161.17 g/mol
LogP0.24
Rot. Bonds1

About 6-pyrazol-1-ylpyrimidin-4-amine

6-pyrazol-1-ylpyrimidin-4-amine (PubChem CID 10749494) has the molecular formula C7H7N5 and a molecular weight of 161.17 g/mol. Its IUPAC name is 6-pyrazol-1-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-pyrazol-1-ylpyrimidin-4-amine
PubChem CID10749494
Molecular FormulaC7H7N5
Molecular Weight161.17 g/mol
Exact Mass161.07
IUPAC Name6-pyrazol-1-ylpyrimidin-4-amine
SMILESNc1cc(-n2cccn2)ncn1
InChIInChI=1S/C7H7N5/c8-6-4-7(10-5-9-6)12-3-1-2-11-12/h1-5H,(H2,8,9,10)
InChIKeyWAQXCJDLNSZZSS-UHFFFAOYSA-N
XLogP0.24
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.17
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-pyrazol-1-ylpyrimidin-4-amine?
The IUPAC name of 6-pyrazol-1-ylpyrimidin-4-amine (CID 10749494) is 6-pyrazol-1-ylpyrimidin-4-amine.
What is the SMILES notation for 6-pyrazol-1-ylpyrimidin-4-amine?
The canonical SMILES for 6-pyrazol-1-ylpyrimidin-4-amine is Nc1cc(-n2cccn2)ncn1.
What is the InChIKey of 6-pyrazol-1-ylpyrimidin-4-amine?
The InChIKey is WAQXCJDLNSZZSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N5/c8-6-4-7(10-5-9-6)12-3-1-2-11-12/h1-5H,(H2,8,9,10).
What are the key properties of 6-pyrazol-1-ylpyrimidin-4-amine?
6-pyrazol-1-ylpyrimidin-4-amine has a molecular weight of 161.17 g/mol, XLogP of 0.24, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyrazol-1-ylpyrimidin-4-amine is sourced from PubChem (CID 10749494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).