5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole

C10H12N4 — CID 169229238

IUPAC5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole
SMILESCn1cncc1-c1cn[nH]c1C1CC1
InChIInChI=1S/C10H12N4/c1-14-6-11-5-9(14)8-4-12-13-10(8)7-2-3-7/h4-7H,2-3H2,1H3,(H,12,13)
InChIKeyRWVFTNGERISWNQ-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.69
Rot. Bonds2

About 5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole

5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole (PubChem CID 169229238) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole.

Molecular Properties

Compound Name5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole
PubChem CID169229238
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole
SMILESCn1cncc1-c1cn[nH]c1C1CC1
InChIInChI=1S/C10H12N4/c1-14-6-11-5-9(14)8-4-12-13-10(8)7-2-3-7/h4-7H,2-3H2,1H3,(H,12,13)
InChIKeyRWVFTNGERISWNQ-UHFFFAOYSA-N
XLogP1.69
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole?
The IUPAC name of 5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole (CID 169229238) is 5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole.
What is the SMILES notation for 5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole?
The canonical SMILES for 5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole is Cn1cncc1-c1cn[nH]c1C1CC1.
What is the InChIKey of 5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole?
The InChIKey is RWVFTNGERISWNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-14-6-11-5-9(14)8-4-12-13-10(8)7-2-3-7/h4-7H,2-3H2,1H3,(H,12,13).
What are the key properties of 5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole?
5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole has a molecular weight of 188.23 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-4-(3-methylimidazol-4-yl)-1H-pyrazole is sourced from PubChem (CID 169229238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).