2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide

C17H25N3O2 — CID 134270265

IUPAC2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide
SMILESC[C@@H]1CCCN1C(=O)[C@H](NC(=O)CN(C)C)c1ccccc1
InChIInChI=1S/C17H25N3O2/c1-13-8-7-11-20(13)17(22)16(14-9-5-4-6-10-14)18-15(21)12-19(2)3/h4-6,9-10,13,16H,7-8,11-12H2,1-3H3,(H,18,21)/t13-,16-/m1/s1
InChIKeyWYRVSMJXZIMIKG-CZUORRHYSA-N
MW303.41 g/mol
LogP1.42
Rot. Bonds5

About 2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide

2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide (PubChem CID 134270265) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide
PubChem CID134270265
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC Name2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide
SMILESC[C@@H]1CCCN1C(=O)[C@H](NC(=O)CN(C)C)c1ccccc1
InChIInChI=1S/C17H25N3O2/c1-13-8-7-11-20(13)17(22)16(14-9-5-4-6-10-14)18-15(21)12-19(2)3/h4-6,9-10,13,16H,7-8,11-12H2,1-3H3,(H,18,21)/t13-,16-/m1/s1
InChIKeyWYRVSMJXZIMIKG-CZUORRHYSA-N
XLogP1.42
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]propanamide
CID 134270184
methyl N-[(1R)-2-[(2S)-2-carbamoylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]carbamate
CID 71164933
methyl N-[2-[(2S)-2-[5-[6-[4-[2-[(2S)-1-[(2R)-2-[[2-(dimethylamino)acetyl]amino]-2-phenylacetyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]phenyl]naphthalen-2-yl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-oxoethyl]carbamate
CID 67682506
[2-[2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxo-1-phenylethyl]urea
CID 61408635
methyl N-[(1S)-2-oxo-1-phenyl-2-[(2S)-2-(propan-2-ylcarbamoyl)pyrrolidin-1-yl]ethyl]carbamate
CID 59616659
N-benzhydryl-2-methylpiperidine-1-carboxamide
CID 108867475
1-[(2R)-2-methylpyrrolidin-1-yl]-2-[[(1R)-1-phenylethyl]amino]ethanone
CID 71047036
N'-hydroxy-3-(2-methylpyrrolidin-1-yl)-3-oxo-2-phenylpropanimidamide
CID 76975453
(2S)-2-[[(2S)-1-[(2S)-2-methylpiperidin-1-yl]-1-oxopropan-2-yl]carbamoylamino]-2-phenylacetamide
CID 95338642
2-amino-1-(2-methylpiperidin-1-yl)-2-phenylethanone
CID 24694891
[(1R)-2-[(2S)-2-[5-[4-[4-[2-[(2S)-1-[2-(dimethylamino)acetyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]phenyl]phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-oxo-1-phenylethyl]carbamic acid
CID 68606205
methyl (2S)-1-[(2R)-2-(2-methylpropoxycarbonylamino)-2-phenylacetyl]pyrrolidine-2-carboxylate
CID 54322299

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide?
The IUPAC name of 2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide (CID 134270265) is 2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide?
The canonical SMILES for 2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide is C[C@@H]1CCCN1C(=O)[C@H](NC(=O)CN(C)C)c1ccccc1.
What is the InChIKey of 2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide?
The InChIKey is WYRVSMJXZIMIKG-CZUORRHYSA-N. The full InChI is InChI=1S/C17H25N3O2/c1-13-8-7-11-20(13)17(22)16(14-9-5-4-6-10-14)18-15(21)12-19(2)3/h4-6,9-10,13,16H,7-8,11-12H2,1-3H3,(H,18,21)/t13-,16-/m1/s1.
What are the key properties of 2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide?
2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide has a molecular weight of 303.41 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[(1R)-2-[(2R)-2-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]acetamide is sourced from PubChem (CID 134270265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).