4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine

C10H10N4 — CID 151889489

IUPAC4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine
SMILESc1cc(-c2cc(C3CC3)[nH]n2)ncn1
InChIInChI=1S/C10H10N4/c1-2-7(1)9-5-10(14-13-9)8-3-4-11-6-12-8/h3-7H,1-2H2,(H,13,14)
InChIKeySQKXLPWEBQCVQN-UHFFFAOYSA-N
MW186.22 g/mol
LogP1.74
Rot. Bonds2

About 4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine

4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine (PubChem CID 151889489) has the molecular formula C10H10N4 and a molecular weight of 186.22 g/mol. Its IUPAC name is 4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine.

Molecular Properties

Compound Name4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine
PubChem CID151889489
Molecular FormulaC10H10N4
Molecular Weight186.22 g/mol
Exact Mass186.09
IUPAC Name4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine
SMILESc1cc(-c2cc(C3CC3)[nH]n2)ncn1
InChIInChI=1S/C10H10N4/c1-2-7(1)9-5-10(14-13-9)8-3-4-11-6-12-8/h3-7H,1-2H2,(H,13,14)
InChIKeySQKXLPWEBQCVQN-UHFFFAOYSA-N
XLogP1.74
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.22
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine?
The IUPAC name of 4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine (CID 151889489) is 4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine.
What is the SMILES notation for 4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine?
The canonical SMILES for 4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine is c1cc(-c2cc(C3CC3)[nH]n2)ncn1.
What is the InChIKey of 4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine?
The InChIKey is SQKXLPWEBQCVQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4/c1-2-7(1)9-5-10(14-13-9)8-3-4-11-6-12-8/h3-7H,1-2H2,(H,13,14).
What are the key properties of 4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine?
4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine has a molecular weight of 186.22 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine is sourced from PubChem (CID 151889489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).