2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide

C9H17N3O3 — CID 169304162

IUPAC2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide
SMILESCON(C)C(=O)C(N)C[C@@H]1CCNC1=O
InChIInChI=1S/C9H17N3O3/c1-12(15-2)9(14)7(10)5-6-3-4-11-8(6)13/h6-7H,3-5,10H2,1-2H3,(H,11,13)/t6-,7?/m0/s1
InChIKeyOIPBEOVBTUXJQN-PKPIPKONSA-N
MW215.25 g/mol
LogP-1.14
Rot. Bonds4

About 2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide

2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide (PubChem CID 169304162) has the molecular formula C9H17N3O3 and a molecular weight of 215.25 g/mol. Its IUPAC name is 2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide.

Molecular Properties

Compound Name2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide
PubChem CID169304162
Molecular FormulaC9H17N3O3
Molecular Weight215.25 g/mol
Exact Mass215.13
IUPAC Name2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide
SMILESCON(C)C(=O)C(N)C[C@@H]1CCNC1=O
InChIInChI=1S/C9H17N3O3/c1-12(15-2)9(14)7(10)5-6-3-4-11-8(6)13/h6-7H,3-5,10H2,1-2H3,(H,11,13)/t6-,7?/m0/s1
InChIKeyOIPBEOVBTUXJQN-PKPIPKONSA-N
XLogP-1.14
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-1.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide?
The IUPAC name of 2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide (CID 169304162) is 2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide.
What is the SMILES notation for 2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide?
The canonical SMILES for 2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide is CON(C)C(=O)C(N)C[C@@H]1CCNC1=O.
What is the InChIKey of 2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide?
The InChIKey is OIPBEOVBTUXJQN-PKPIPKONSA-N. The full InChI is InChI=1S/C9H17N3O3/c1-12(15-2)9(14)7(10)5-6-3-4-11-8(6)13/h6-7H,3-5,10H2,1-2H3,(H,11,13)/t6-,7?/m0/s1.
What are the key properties of 2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide?
2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide has a molecular weight of 215.25 g/mol, XLogP of -1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methoxy-N-methyl-3-[(3S)-2-oxopyrrolidin-3-yl]propanamide is sourced from PubChem (CID 169304162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).