(1-ethylpyrazol-3-yl)methanol

C6H10N2O — CID 22287713

IUPAC(1-ethylpyrazol-3-yl)methanol
SMILESCCn1ccc(CO)n1
InChIInChI=1S/C6H10N2O/c1-2-8-4-3-6(5-9)7-8/h3-4,9H,2,5H2,1H3
InChIKeyANWZXIXYZAZLPB-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.40
Rot. Bonds2

About (1-ethylpyrazol-3-yl)methanol

(1-ethylpyrazol-3-yl)methanol (PubChem CID 22287713) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is (1-ethylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(1-ethylpyrazol-3-yl)methanol
PubChem CID22287713
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name(1-ethylpyrazol-3-yl)methanol
SMILESCCn1ccc(CO)n1
InChIInChI=1S/C6H10N2O/c1-2-8-4-3-6(5-9)7-8/h3-4,9H,2,5H2,1H3
InChIKeyANWZXIXYZAZLPB-UHFFFAOYSA-N
XLogP0.40
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-ethylpyrazol-3-yl)methanol?
The IUPAC name of (1-ethylpyrazol-3-yl)methanol (CID 22287713) is (1-ethylpyrazol-3-yl)methanol.
What is the SMILES notation for (1-ethylpyrazol-3-yl)methanol?
The canonical SMILES for (1-ethylpyrazol-3-yl)methanol is CCn1ccc(CO)n1.
What is the InChIKey of (1-ethylpyrazol-3-yl)methanol?
The InChIKey is ANWZXIXYZAZLPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-2-8-4-3-6(5-9)7-8/h3-4,9H,2,5H2,1H3.
What are the key properties of (1-ethylpyrazol-3-yl)methanol?
(1-ethylpyrazol-3-yl)methanol has a molecular weight of 126.16 g/mol, XLogP of 0.40, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylpyrazol-3-yl)methanol is sourced from PubChem (CID 22287713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).