1-amino-5-methoxypyrrolidin-2-one

C5H10N2O2 — CID 123886673

IUPAC1-amino-5-methoxypyrrolidin-2-one
SMILESCOC1CCC(=O)N1N
InChIInChI=1S/C5H10N2O2/c1-9-5-3-2-4(8)7(5)6/h5H,2-3,6H2,1H3
InChIKeyNWWNIQJSEHKVEV-UHFFFAOYSA-N
MW130.15 g/mol
LogP-0.55
Rot. Bonds1

About 1-amino-5-methoxypyrrolidin-2-one

1-amino-5-methoxypyrrolidin-2-one (PubChem CID 123886673) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is 1-amino-5-methoxypyrrolidin-2-one.

Molecular Properties

Compound Name1-amino-5-methoxypyrrolidin-2-one
PubChem CID123886673
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name1-amino-5-methoxypyrrolidin-2-one
SMILESCOC1CCC(=O)N1N
InChIInChI=1S/C5H10N2O2/c1-9-5-3-2-4(8)7(5)6/h5H,2-3,6H2,1H3
InChIKeyNWWNIQJSEHKVEV-UHFFFAOYSA-N
XLogP-0.55
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Related Compounds

(5S)-5-methoxy-1-propan-2-ylpyrrolidin-2-one
CID 178109240
(5S,8aR)-5-methoxy-2,5,6,7,8,8a-hexahydro-1H-indolizin-3-one
CID 11829854
(5S,9aR)-5-methoxy-1,2,5,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepin-3-one
CID 102314656
tert-butyl (2R)-2-methoxy-5-oxopyrrolidine-1-carboxylate
CID 99978734
4-O-(1-ethyl-5-oxopyrrolidin-2-yl) 1-O-methyl (E)-but-2-enedioate
CID 122480504
3-hydroxy-1-methoxypiperidine-2,6-dione
CID 167136496
(1-amino-5-oxopyrrolidin-2-yl)phosphonic acid
CID 85423754
5-methoxy-1-methylazepan-2-one
CID 59421614
1-(2-bromoethyl)-5-ethoxypyrrolidin-2-one
CID 13048223
(5R)-1-ethyl-5-methoxypiperidin-2-one
CID 170617785
(4R)-4-methoxy-1-methylpiperidin-2-one
CID 118584700
1-amino-5-propan-2-ylpyrrolidin-2-one;2,2,2-trifluoroacetic acid
CID 174891244

Frequently Asked Questions

What is the IUPAC name of 1-amino-5-methoxypyrrolidin-2-one?
The IUPAC name of 1-amino-5-methoxypyrrolidin-2-one (CID 123886673) is 1-amino-5-methoxypyrrolidin-2-one.
What is the SMILES notation for 1-amino-5-methoxypyrrolidin-2-one?
The canonical SMILES for 1-amino-5-methoxypyrrolidin-2-one is COC1CCC(=O)N1N.
What is the InChIKey of 1-amino-5-methoxypyrrolidin-2-one?
The InChIKey is NWWNIQJSEHKVEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2/c1-9-5-3-2-4(8)7(5)6/h5H,2-3,6H2,1H3.
What are the key properties of 1-amino-5-methoxypyrrolidin-2-one?
1-amino-5-methoxypyrrolidin-2-one has a molecular weight of 130.15 g/mol, XLogP of -0.55, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-5-methoxypyrrolidin-2-one is sourced from PubChem (CID 123886673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).