5-(oxolan-2-yl)-1H-pyrazole

C7H10N2O — CID 118097404

IUPAC5-(oxolan-2-yl)-1H-pyrazole
SMILESc1cc(C2CCCO2)[nH]n1
InChIInChI=1S/C7H10N2O/c1-2-7(10-5-1)6-3-4-8-9-6/h3-4,7H,1-2,5H2,(H,8,9)
InChIKeyYFEXGHZLWGJCQF-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.26
Rot. Bonds1

About 5-(oxolan-2-yl)-1H-pyrazole

5-(oxolan-2-yl)-1H-pyrazole (PubChem CID 118097404) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 5-(oxolan-2-yl)-1H-pyrazole.

Molecular Properties

Compound Name5-(oxolan-2-yl)-1H-pyrazole
PubChem CID118097404
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name5-(oxolan-2-yl)-1H-pyrazole
SMILESc1cc(C2CCCO2)[nH]n1
InChIInChI=1S/C7H10N2O/c1-2-7(10-5-1)6-3-4-8-9-6/h3-4,7H,1-2,5H2,(H,8,9)
InChIKeyYFEXGHZLWGJCQF-UHFFFAOYSA-N
XLogP1.26
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 54210127
3-(oxolan-2-yl)-1H-pyrazol-5-amine
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[5-(1H-pyrazol-5-yl)oxolan-2-yl]methanamine
CID 122163866
3-Trifluoro-methyl-1-ethoxymethylpyrazole
CID 134612665
Trimethyl-pyrazolylcarbinol
CID 129768715
Pyrazolylpyran
CID 129814505
5-(4-bromo-3-fluorooxan-2-yl)-1H-pyrazole
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5-(5-azido-6,6-difluorooxepan-2-yl)-1H-pyrazole
CID 150136423
5-(5-azido-6-fluorooxepan-2-yl)-1H-pyrazole
CID 150365215
5-(5-azido-4-fluorooxepan-2-yl)-1H-pyrazole
CID 150894549
3-[2-[(4-fluoro-1H-pyrazol-5-yl)methoxy]propyl]-5-(propan-2-yloxymethyl)-1H-pyrazole
CID 170601880
5-[(4S,5S)-2,2-dimethyl-5-(1H-pyrazol-5-yl)-1,3-dioxolan-4-yl]-1H-pyrazole
CID 13808433

Frequently Asked Questions

What is the IUPAC name of 5-(oxolan-2-yl)-1H-pyrazole?
The IUPAC name of 5-(oxolan-2-yl)-1H-pyrazole (CID 118097404) is 5-(oxolan-2-yl)-1H-pyrazole.
What is the SMILES notation for 5-(oxolan-2-yl)-1H-pyrazole?
The canonical SMILES for 5-(oxolan-2-yl)-1H-pyrazole is c1cc(C2CCCO2)[nH]n1.
What is the InChIKey of 5-(oxolan-2-yl)-1H-pyrazole?
The InChIKey is YFEXGHZLWGJCQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-2-7(10-5-1)6-3-4-8-9-6/h3-4,7H,1-2,5H2,(H,8,9).
What are the key properties of 5-(oxolan-2-yl)-1H-pyrazole?
5-(oxolan-2-yl)-1H-pyrazole has a molecular weight of 138.17 g/mol, XLogP of 1.26, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxolan-2-yl)-1H-pyrazole is sourced from PubChem (CID 118097404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).