methanol;1H-pyrazole

C4H8N2O — CID 18956708

IUPACmethanol;1H-pyrazole
SMILESCO.c1cn[nH]c1
InChIInChI=1S/C3H4N2.CH4O/c1-2-4-5-3-1;1-2/h1-3H,(H,4,5);2H,1H3
InChIKeyYKEKWOJUUNYRIR-UHFFFAOYSA-N
MW100.12 g/mol
LogP0.02
Rot. Bonds

About methanol;1H-pyrazole

methanol;1H-pyrazole (PubChem CID 18956708) has the molecular formula C4H8N2O and a molecular weight of 100.12 g/mol. Its IUPAC name is methanol;1H-pyrazole.

Molecular Properties

Compound Namemethanol;1H-pyrazole
PubChem CID18956708
Molecular FormulaC4H8N2O
Molecular Weight100.12 g/mol
Exact Mass100.06
IUPAC Namemethanol;1H-pyrazole
SMILESCO.c1cn[nH]c1
InChIInChI=1S/C3H4N2.CH4O/c1-2-4-5-3-1;1-2/h1-3H,(H,4,5);2H,1H3
InChIKeyYKEKWOJUUNYRIR-UHFFFAOYSA-N
XLogP0.02
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.12
LogP ≤ 50.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze methanol;1H-pyrazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methanol;1H-pyrazole?
The IUPAC name of methanol;1H-pyrazole (CID 18956708) is methanol;1H-pyrazole.
What is the SMILES notation for methanol;1H-pyrazole?
The canonical SMILES for methanol;1H-pyrazole is CO.c1cn[nH]c1.
What is the InChIKey of methanol;1H-pyrazole?
The InChIKey is YKEKWOJUUNYRIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2.CH4O/c1-2-4-5-3-1;1-2/h1-3H,(H,4,5);2H,1H3.
What are the key properties of methanol;1H-pyrazole?
methanol;1H-pyrazole has a molecular weight of 100.12 g/mol, XLogP of 0.02, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;1H-pyrazole is sourced from PubChem (CID 18956708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).