2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene

C10H19N3O2 — CID 166112266

IUPAC2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene
SMILESC=CC.NC(=O)C(N)CC1CCNC1=O
InChIInChI=1S/C7H13N3O2.C3H6/c8-5(6(9)11)3-4-1-2-10-7(4)12;1-3-2/h4-5H,1-3,8H2,(H2,9,11)(H,10,12);3H,1H2,2H3
InChIKeyNOGHJONVUIXQDM-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.48
Rot. Bonds3

About 2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene

2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene (PubChem CID 166112266) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene.

Molecular Properties

Compound Name2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene
PubChem CID166112266
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene
SMILESC=CC.NC(=O)C(N)CC1CCNC1=O
InChIInChI=1S/C7H13N3O2.C3H6/c8-5(6(9)11)3-4-1-2-10-7(4)12;1-3-2/h4-5H,1-3,8H2,(H2,9,11)(H,10,12);3H,1H2,2H3
InChIKeyNOGHJONVUIXQDM-UHFFFAOYSA-N
XLogP-0.48
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-amino-3-(2-oxopyrrolidin-3-yl)propanamide
CID 166112267
(3S)-3-(2-amino-4-chloro-3-oxobutyl)pyrrolidin-2-one
CID 143139104
methanesulfonic acid;methyl (2S)-2-amino-3-[(3S)-2-oxopyrrolidin-3-yl]propanoate
CID 163323578
3-(2-aminopropyl)pyrrolidin-2-one
CID 82651299
(2S)-2-amino-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-3-cyclopropylpropanamide
CID 166840656
(2S)-2-[(2-aminoacetyl)amino]-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide
CID 167203166
(3R)-3-[(2S)-2-methylbut-3-enyl]pyrrolidin-2-one
CID 163537974
2-amino-3-(2-oxopiperidin-3-yl)propanoic acid
CID 22247801
(2S)-2-amino-N-[(2S)-1-amino-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]-4-methylpentanamide;methanesulfonic acid
CID 175731532
3-(2-aminobut-3-ynyl)pyrrolidin-2-one;methanol
CID 171843230
3-[(2S)-3-hydroxy-2-(methylamino)propyl]pyrrolidin-2-one
CID 58593524
2-[(2S)-1-oxo-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]pentanamide
CID 164850299

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene?
The IUPAC name of 2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene (CID 166112266) is 2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene.
What is the SMILES notation for 2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene?
The canonical SMILES for 2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene is C=CC.NC(=O)C(N)CC1CCNC1=O.
What is the InChIKey of 2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene?
The InChIKey is NOGHJONVUIXQDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O2.C3H6/c8-5(6(9)11)3-4-1-2-10-7(4)12;1-3-2/h4-5H,1-3,8H2,(H2,9,11)(H,10,12);3H,1H2,2H3.
What are the key properties of 2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene?
2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene has a molecular weight of 213.28 g/mol, XLogP of -0.48, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(2-oxopyrrolidin-3-yl)propanamide;prop-1-ene is sourced from PubChem (CID 166112266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).