1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide

C17H25N3O2 — CID 70547398

IUPAC1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide
SMILESCC(C)(N)CN1CCCC1C(=O)NC(=O)Cc1ccccc1
InChIInChI=1S/C17H25N3O2/c1-17(2,18)12-20-10-6-9-14(20)16(22)19-15(21)11-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12,18H2,1-2H3,(H,19,21,22)
InChIKeyMRFUSOYEXOWMJG-UHFFFAOYSA-N
MW303.41 g/mol
LogP1.07
Rot. Bonds5

About 1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide

1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide (PubChem CID 70547398) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is 1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide
PubChem CID70547398
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC Name1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide
SMILESCC(C)(N)CN1CCCC1C(=O)NC(=O)Cc1ccccc1
InChIInChI=1S/C17H25N3O2/c1-17(2,18)12-20-10-6-9-14(20)16(22)19-15(21)11-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12,18H2,1-2H3,(H,19,21,22)
InChIKeyMRFUSOYEXOWMJG-UHFFFAOYSA-N
XLogP1.07
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1-benzylpyrrolidin-2-yl)-2,2-dimethylpropan-1-one
CID 70799307
N-methyl-1-(2-oxo-3-phenylpropyl)piperidine-2-carboxamide
CID 62036084
N-[2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]acetyl]-2-phenylacetamide
CID 66260986
(2R)-1-benzyl-N-(2-hydroxyphenyl)pyrrolidine-2-carboxamide
CID 51861391
(2S)-N-benzyl-1-[2-(4-tert-butylcyclohexyl)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 67620978
1-(1-methylpyrrolidin-2-yl)-2-phenylethanone
CID 129033929
methyl 1-benzylpyrrolidine-2-carboxylate
CID 562947
(2S)-1-[(2R,3S)-3-amino-2-hydroxy-4-phenylbutyl]-N-tert-butylpyrrolidine-2-carboxamide;molecular nitrogen
CID 131719114
ethyl N-[(1-benzylpyrrolidine-2-carbonyl)amino]carbamate
CID 60579128
benzyl N-[(2S)-1-methylpyrrolidine-2-carbonyl]carbamate
CID 90115821
(2S)-N-(2-hydroxy-2,2-diphenylacetyl)-1-phenacylpyrrolidine-2-carboxamide
CID 139629640
(2S)-1-benzyl-N-butylpyrrolidine-2-carboxamide
CID 131848769

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide (CID 70547398) is 1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide is CC(C)(N)CN1CCCC1C(=O)NC(=O)Cc1ccccc1.
What is the InChIKey of 1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide?
The InChIKey is MRFUSOYEXOWMJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c1-17(2,18)12-20-10-6-9-14(20)16(22)19-15(21)11-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12,18H2,1-2H3,(H,19,21,22).
What are the key properties of 1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide?
1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide has a molecular weight of 303.41 g/mol, XLogP of 1.07, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-methylpropyl)-N-(2-phenylacetyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 70547398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).