(4-ethyl-1H-pyrazol-5-yl)methanol

C6H10N2O — CID 69826781

IUPAC(4-ethyl-1H-pyrazol-5-yl)methanol
SMILESCCC1=C(NN=C1)CO
InChIInChI=1S/C6H10N2O/c1-2-5-3-7-8-6(5)4-9/h3,9H,2,4H2,1H3,(H,7,8)
InChIKeyMHQZNQPVSFEQMT-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.20
Rot. Bonds2

About (4-ethyl-1H-pyrazol-5-yl)methanol

(4-ethyl-1H-pyrazol-5-yl)methanol (PubChem CID 69826781) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is (4-ethyl-1H-pyrazol-5-yl)methanol.

Molecular Properties

Compound Name(4-ethyl-1H-pyrazol-5-yl)methanol
PubChem CID69826781
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name(4-ethyl-1H-pyrazol-5-yl)methanol
SMILESCCC1=C(NN=C1)CO
InChIInChI=1S/C6H10N2O/c1-2-5-3-7-8-6(5)4-9/h3,9H,2,4H2,1H3,(H,7,8)
InChIKeyMHQZNQPVSFEQMT-UHFFFAOYSA-N
XLogP0.20
TPSA48.90 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity87

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-ethyl-1H-pyrazol-5-yl)methanol?
The IUPAC name of (4-ethyl-1H-pyrazol-5-yl)methanol (CID 69826781) is (4-ethyl-1H-pyrazol-5-yl)methanol.
What is the SMILES notation for (4-ethyl-1H-pyrazol-5-yl)methanol?
The canonical SMILES for (4-ethyl-1H-pyrazol-5-yl)methanol is CCC1=C(NN=C1)CO.
What is the InChIKey of (4-ethyl-1H-pyrazol-5-yl)methanol?
The InChIKey is MHQZNQPVSFEQMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-2-5-3-7-8-6(5)4-9/h3,9H,2,4H2,1H3,(H,7,8).
What are the key properties of (4-ethyl-1H-pyrazol-5-yl)methanol?
(4-ethyl-1H-pyrazol-5-yl)methanol has a molecular weight of 126.16 g/mol, XLogP of 0.20, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethyl-1H-pyrazol-5-yl)methanol is sourced from PubChem (CID 69826781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).