2-amino-2,3-dihydro-1H-pyrrol-4-ol

C4H8N2O — CID 174271669

IUPAC2-amino-2,3-dihydro-1H-pyrrol-4-ol
SMILESNC1CC(O)=CN1
InChIInChI=1S/C4H8N2O/c5-4-1-3(7)2-6-4/h2,4,6-7H,1,5H2
InChIKeyHGOUSWGPLIRPTA-UHFFFAOYSA-N
MW100.12 g/mol
LogP-0.34
Rot. Bonds

About 2-amino-2,3-dihydro-1H-pyrrol-4-ol

2-amino-2,3-dihydro-1H-pyrrol-4-ol (PubChem CID 174271669) has the molecular formula C4H8N2O and a molecular weight of 100.12 g/mol. Its IUPAC name is 2-amino-2,3-dihydro-1H-pyrrol-4-ol.

Molecular Properties

Compound Name2-amino-2,3-dihydro-1H-pyrrol-4-ol
PubChem CID174271669
Molecular FormulaC4H8N2O
Molecular Weight100.12 g/mol
Exact Mass100.06
IUPAC Name2-amino-2,3-dihydro-1H-pyrrol-4-ol
SMILESNC1CC(O)=CN1
InChIInChI=1S/C4H8N2O/c5-4-1-3(7)2-6-4/h2,4,6-7H,1,5H2
InChIKeyHGOUSWGPLIRPTA-UHFFFAOYSA-N
XLogP-0.34
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.12
LogP ≤ 5-0.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2,3-dihydro-1H-pyrrol-4-ol?
The IUPAC name of 2-amino-2,3-dihydro-1H-pyrrol-4-ol (CID 174271669) is 2-amino-2,3-dihydro-1H-pyrrol-4-ol.
What is the SMILES notation for 2-amino-2,3-dihydro-1H-pyrrol-4-ol?
The canonical SMILES for 2-amino-2,3-dihydro-1H-pyrrol-4-ol is NC1CC(O)=CN1.
What is the InChIKey of 2-amino-2,3-dihydro-1H-pyrrol-4-ol?
The InChIKey is HGOUSWGPLIRPTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2O/c5-4-1-3(7)2-6-4/h2,4,6-7H,1,5H2.
What are the key properties of 2-amino-2,3-dihydro-1H-pyrrol-4-ol?
2-amino-2,3-dihydro-1H-pyrrol-4-ol has a molecular weight of 100.12 g/mol, XLogP of -0.34, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2,3-dihydro-1H-pyrrol-4-ol is sourced from PubChem (CID 174271669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).