2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide

C18H25N3O3 — CID 120795162

IUPAC2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide
SMILESCC1CC(NC(=O)C(N)C2CCOCC2)C(=O)N1c1ccccc1
InChIInChI=1S/C18H25N3O3/c1-12-11-15(18(23)21(12)14-5-3-2-4-6-14)20-17(22)16(19)13-7-9-24-10-8-13/h2-6,12-13,15-16H,7-11,19H2,1H3,(H,20,22)
InChIKeyVNQINSNJAIOWSZ-UHFFFAOYSA-N
MW331.42 g/mol
LogP1.05
Rot. Bonds4

About 2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide

2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide (PubChem CID 120795162) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is 2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide
PubChem CID120795162
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC Name2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide
SMILESCC1CC(NC(=O)C(N)C2CCOCC2)C(=O)N1c1ccccc1
InChIInChI=1S/C18H25N3O3/c1-12-11-15(18(23)21(12)14-5-3-2-4-6-14)20-17(22)16(19)13-7-9-24-10-8-13/h2-6,12-13,15-16H,7-11,19H2,1H3,(H,20,22)
InChIKeyVNQINSNJAIOWSZ-UHFFFAOYSA-N
XLogP1.05
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-2-(oxan-4-yl)-N-(2-oxo-1-phenylpyrrolidin-3-yl)acetamide;hydrochloride
CID 120792867
2-amino-2-(oxan-4-yl)-N-(2-oxo-1-phenylpiperidin-3-yl)acetamide
CID 120793480
2-chloro-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)propanamide
CID 146085997
2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668914
2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-4-yl)acetamide
CID 120798994
cis-(1S,3R)-2,2-dimethyl-3-[(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 122065674
2-amino-2-(oxan-4-yl)-N-(1-phenylpiperidin-3-yl)acetamide;dihydrochloride
CID 120800731
2-(1,3-dioxan-2-yl)-N-[(3S,5S)-5-methyl-2-oxo-1-phenylpyrrolidin-3-yl]acetamide
CID 124626029
3-methyl-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)but-2-enamide
CID 71998925
3-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)cyclohexane-1-carboxamide
CID 119806294
N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)piperidine-4-carboxamide;hydrochloride
CID 119336511
2-amino-N-(2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide
CID 120796324

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide?
The IUPAC name of 2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide (CID 120795162) is 2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide.
What is the SMILES notation for 2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide?
The canonical SMILES for 2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide is CC1CC(NC(=O)C(N)C2CCOCC2)C(=O)N1c1ccccc1.
What is the InChIKey of 2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide?
The InChIKey is VNQINSNJAIOWSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3/c1-12-11-15(18(23)21(12)14-5-3-2-4-6-14)20-17(22)16(19)13-7-9-24-10-8-13/h2-6,12-13,15-16H,7-11,19H2,1H3,(H,20,22).
What are the key properties of 2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide?
2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide has a molecular weight of 331.42 g/mol, XLogP of 1.05, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-methyl-2-oxo-1-phenylpyrrolidin-3-yl)-2-(oxan-4-yl)acetamide is sourced from PubChem (CID 120795162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).