2,3-dihydro-1H-pyrrol-3-ol

C4H7NO — CID 18185791

IUPAC2,3-dihydro-1H-pyrrol-3-ol
SMILESOC1C=CNC1
InChIInChI=1S/C4H7NO/c6-4-1-2-5-3-4/h1-2,4-6H,3H2
InChIKeyKBIJJDBUDCSTNL-UHFFFAOYSA-N
MW85.11 g/mol
LogP-0.54
Rot. Bonds

About 2,3-dihydro-1H-pyrrol-3-ol

2,3-dihydro-1H-pyrrol-3-ol (PubChem CID 18185791) has the molecular formula C4H7NO and a molecular weight of 85.11 g/mol. Its IUPAC name is 2,3-dihydro-1H-pyrrol-3-ol.

Molecular Properties

Compound Name2,3-dihydro-1H-pyrrol-3-ol
PubChem CID18185791
Molecular FormulaC4H7NO
Molecular Weight85.11 g/mol
Exact Mass85.05
IUPAC Name2,3-dihydro-1H-pyrrol-3-ol
SMILESOC1C=CNC1
InChIInChI=1S/C4H7NO/c6-4-1-2-5-3-4/h1-2,4-6H,3H2
InChIKeyKBIJJDBUDCSTNL-UHFFFAOYSA-N
XLogP-0.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50085.11
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4,5-Dihydroxypyrroline
CID 135319444
3-Buten-2-ol, 1-(propylamino)-
CID 174511
N-allylvinylglycinol
CID 129709867
4-hydroxy pyrroline N-oxide
CID 129843990
(2r,3s)-2-(Hydroxymethyl)-2,3-dihydro-1h-pyrrol-3-ol
CID 155803630
1-(Ethylamino)but-3-en-2-ol
CID 21713280
1-(2-Hydroxyethylamino)but-3-en-2-ol
CID 21713282
1-(Methylamino)but-3-en-2-ol
CID 21713286
1-(Prop-2-enylamino)but-3-en-2-ol
CID 55287177
1,4-Dihydropyridin-4-ol
CID 59994773
(1Z)-1-(methylamino)penta-1,4-dien-3-ol
CID 89324995
(3S)-2,3-dihydro-1H-pyrrol-3-ol
CID 142652205

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-pyrrol-3-ol?
The IUPAC name of 2,3-dihydro-1H-pyrrol-3-ol (CID 18185791) is 2,3-dihydro-1H-pyrrol-3-ol.
What is the SMILES notation for 2,3-dihydro-1H-pyrrol-3-ol?
The canonical SMILES for 2,3-dihydro-1H-pyrrol-3-ol is OC1C=CNC1.
What is the InChIKey of 2,3-dihydro-1H-pyrrol-3-ol?
The InChIKey is KBIJJDBUDCSTNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7NO/c6-4-1-2-5-3-4/h1-2,4-6H,3H2.
What are the key properties of 2,3-dihydro-1H-pyrrol-3-ol?
2,3-dihydro-1H-pyrrol-3-ol has a molecular weight of 85.11 g/mol, XLogP of -0.54, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-pyrrol-3-ol is sourced from PubChem (CID 18185791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).