1-methoxypyrrol-2-ol

C5H7NO2 — CID 18184953

IUPAC1-methoxypyrrol-2-ol
SMILESCOn1cccc1O
InChIInChI=1S/C5H7NO2/c1-8-6-4-2-3-5(6)7/h2-4,7H,1H3
InChIKeyVTVOPTCEVRXFND-UHFFFAOYSA-N
MW113.12 g/mol
LogP0.25
Rot. Bonds1

About 1-methoxypyrrol-2-ol

1-methoxypyrrol-2-ol (PubChem CID 18184953) has the molecular formula C5H7NO2 and a molecular weight of 113.12 g/mol. Its IUPAC name is 1-methoxypyrrol-2-ol.

Molecular Properties

Compound Name1-methoxypyrrol-2-ol
PubChem CID18184953
Molecular FormulaC5H7NO2
Molecular Weight113.12 g/mol
Exact Mass113.05
IUPAC Name1-methoxypyrrol-2-ol
SMILESCOn1cccc1O
InChIInChI=1S/C5H7NO2/c1-8-6-4-2-3-5(6)7/h2-4,7H,1H3
InChIKeyVTVOPTCEVRXFND-UHFFFAOYSA-N
XLogP0.25
TPSA34.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.12
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-methoxypyrrol-2-ol with MolForge

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

Launch Full Analysis

Related Compounds

1H-Pyrrol-2-ol
CID 13795005
1-Methyl-1H-pyrrol-2-ol
CID 13795008
Dioxypyrrole
CID 21225236
1-Methylpyrrole-2,5-diol
CID 21326740
N-acetyl-2-hydroxypyrrole
CID 53746513
1-Hydroxypyrrole-2,5-diol
CID 53887891
1-(Hydroxymethyl)pyrrole-2,5-diol
CID 54060161
1-Ethylpyrrole-2,5-diol
CID 54068298
Pyrrolether
CID 129652402
1-Methyl-4-(trifluoromethyl)pyrrol-2-ol
CID 11321153
1-Fluoropyrrol-2-ol
CID 18185037
(2-Hydroxypyrrol-1-yl) trifluoromethanesulfonate
CID 91397577

Frequently Asked Questions

What is the IUPAC name of 1-methoxypyrrol-2-ol?
The IUPAC name of 1-methoxypyrrol-2-ol (CID 18184953) is 1-methoxypyrrol-2-ol.
What is the SMILES notation for 1-methoxypyrrol-2-ol?
The canonical SMILES for 1-methoxypyrrol-2-ol is COn1cccc1O.
What is the InChIKey of 1-methoxypyrrol-2-ol?
The InChIKey is VTVOPTCEVRXFND-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7NO2/c1-8-6-4-2-3-5(6)7/h2-4,7H,1H3.
What are the key properties of 1-methoxypyrrol-2-ol?
1-methoxypyrrol-2-ol has a molecular weight of 113.12 g/mol, XLogP of 0.25, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxypyrrol-2-ol is sourced from PubChem (CID 18184953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).