(3R)-3-amino-1,3-dihydropyrrol-2-one

C4H6N2O — CID 154264862

IUPAC(3R)-3-amino-1,3-dihydropyrrol-2-one
SMILESN[C@@H]1C=CNC1=O
InChIInChI=1S/C4H6N2O/c5-3-1-2-6-4(3)7/h1-3H,5H2,(H,6,7)/t3-/m1/s1
InChIKeyODRXAWKMDVEPCR-GSVOUGTGSA-N
MW98.10 g/mol
LogP-1.04
Rot. Bonds

About (3R)-3-amino-1,3-dihydropyrrol-2-one

(3R)-3-amino-1,3-dihydropyrrol-2-one (PubChem CID 154264862) has the molecular formula C4H6N2O and a molecular weight of 98.10 g/mol. Its IUPAC name is (3R)-3-amino-1,3-dihydropyrrol-2-one.

Molecular Properties

Compound Name(3R)-3-amino-1,3-dihydropyrrol-2-one
PubChem CID154264862
Molecular FormulaC4H6N2O
Molecular Weight98.10 g/mol
Exact Mass98.05
IUPAC Name(3R)-3-amino-1,3-dihydropyrrol-2-one
SMILESN[C@@H]1C=CNC1=O
InChIInChI=1S/C4H6N2O/c5-3-1-2-6-4(3)7/h1-3H,5H2,(H,6,7)/t3-/m1/s1
InChIKeyODRXAWKMDVEPCR-GSVOUGTGSA-N
XLogP-1.04
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.10
LogP ≤ 5-1.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-1,3-dihydropyrrol-2-one?
The IUPAC name of (3R)-3-amino-1,3-dihydropyrrol-2-one (CID 154264862) is (3R)-3-amino-1,3-dihydropyrrol-2-one.
What is the SMILES notation for (3R)-3-amino-1,3-dihydropyrrol-2-one?
The canonical SMILES for (3R)-3-amino-1,3-dihydropyrrol-2-one is N[C@@H]1C=CNC1=O.
What is the InChIKey of (3R)-3-amino-1,3-dihydropyrrol-2-one?
The InChIKey is ODRXAWKMDVEPCR-GSVOUGTGSA-N. The full InChI is InChI=1S/C4H6N2O/c5-3-1-2-6-4(3)7/h1-3H,5H2,(H,6,7)/t3-/m1/s1.
What are the key properties of (3R)-3-amino-1,3-dihydropyrrol-2-one?
(3R)-3-amino-1,3-dihydropyrrol-2-one has a molecular weight of 98.10 g/mol, XLogP of -1.04, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-1,3-dihydropyrrol-2-one is sourced from PubChem (CID 154264862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).