1-(1H-pyrazol-5-yl)cyclopropan-1-ol

C6H8N2O — CID 63078762

IUPAC1-(1H-pyrazol-5-yl)cyclopropan-1-ol
SMILESOC1(c2ccn[nH]2)CC1
InChIInChI=1S/C6H8N2O/c9-6(2-3-6)5-1-4-7-8-5/h1,4,9H,2-3H2,(H,7,8)
InChIKeyHXNXJQABNNUPKH-UHFFFAOYSA-N
MW124.14 g/mol
LogP0.39
Rot. Bonds1

About 1-(1H-pyrazol-5-yl)cyclopropan-1-ol

1-(1H-pyrazol-5-yl)cyclopropan-1-ol (PubChem CID 63078762) has the molecular formula C6H8N2O and a molecular weight of 124.14 g/mol. Its IUPAC name is 1-(1H-pyrazol-5-yl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(1H-pyrazol-5-yl)cyclopropan-1-ol
PubChem CID63078762
Molecular FormulaC6H8N2O
Molecular Weight124.14 g/mol
Exact Mass124.06
IUPAC Name1-(1H-pyrazol-5-yl)cyclopropan-1-ol
SMILESOC1(c2ccn[nH]2)CC1
InChIInChI=1S/C6H8N2O/c9-6(2-3-6)5-1-4-7-8-5/h1,4,9H,2-3H2,(H,7,8)
InChIKeyHXNXJQABNNUPKH-UHFFFAOYSA-N
XLogP0.39
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.14
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-pyrazol-5-yl)cyclopropan-1-ol?
The IUPAC name of 1-(1H-pyrazol-5-yl)cyclopropan-1-ol (CID 63078762) is 1-(1H-pyrazol-5-yl)cyclopropan-1-ol.
What is the SMILES notation for 1-(1H-pyrazol-5-yl)cyclopropan-1-ol?
The canonical SMILES for 1-(1H-pyrazol-5-yl)cyclopropan-1-ol is OC1(c2ccn[nH]2)CC1.
What is the InChIKey of 1-(1H-pyrazol-5-yl)cyclopropan-1-ol?
The InChIKey is HXNXJQABNNUPKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O/c9-6(2-3-6)5-1-4-7-8-5/h1,4,9H,2-3H2,(H,7,8).
What are the key properties of 1-(1H-pyrazol-5-yl)cyclopropan-1-ol?
1-(1H-pyrazol-5-yl)cyclopropan-1-ol has a molecular weight of 124.14 g/mol, XLogP of 0.39, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-pyrazol-5-yl)cyclopropan-1-ol is sourced from PubChem (CID 63078762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).