3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide

C17H27N3O — CID 63217523

IUPAC3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide
SMILESCCNC(CN1CCCC1(C)C)(C(N)=O)c1ccccc1
InChIInChI=1S/C17H27N3O/c1-4-19-17(15(18)21,14-9-6-5-7-10-14)13-20-12-8-11-16(20,2)3/h5-7,9-10,19H,4,8,11-13H2,1-3H3,(H2,18,21)
InChIKeyFQXCUJXGENIJAK-UHFFFAOYSA-N
MW289.42 g/mol
LogP1.85
Rot. Bonds6

About 3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide

3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide (PubChem CID 63217523) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide.

Molecular Properties

Compound Name3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide
PubChem CID63217523
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide
SMILESCCNC(CN1CCCC1(C)C)(C(N)=O)c1ccccc1
InChIInChI=1S/C17H27N3O/c1-4-19-17(15(18)21,14-9-6-5-7-10-14)13-20-12-8-11-16(20,2)3/h5-7,9-10,19H,4,8,11-13H2,1-3H3,(H2,18,21)
InChIKeyFQXCUJXGENIJAK-UHFFFAOYSA-N
XLogP1.85
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-4-(2,2-dimethylpyrrolidin-1-yl)-2-phenylbutanamide
CID 116693857
3-(2,2-dimethylpyrrolidin-1-yl)-2-phenyl-2-(propylamino)propan-1-ol
CID 64791689
2-(ethylamino)-2,3-diphenylpropanamide
CID 60787050
4-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-methylbutanamide
CID 63217659
3-(2,2-dimethylpyrrolidin-1-yl)-2,2-dimethyl-1-phenylpropan-1-ol
CID 63218416
2-(ethylamino)-3-(oxan-4-ylsulfanyl)-2-phenylpropanamide
CID 62991235
4-[(2,2-dimethylpyrrolidin-1-yl)methyl]benzoic acid
CID 55220247
2-(ethylamino)-3-(2-methylpentoxy)-2-phenylpropanamide
CID 103284960
2-(3-chlorophenyl)-2-(ethylamino)butanamide
CID 60786890
1-benzyl-2,2-dimethylpyrrolidine
CID 10954329
2-amino-4-(2,2-dimethylpyrrolidin-1-yl)-2-phenylbutanenitrile
CID 116692576
2-(cyclopropylmethylamino)-2-phenylpentanamide
CID 54890154

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide?
The IUPAC name of 3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide (CID 63217523) is 3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide.
What is the SMILES notation for 3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide?
The canonical SMILES for 3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide is CCNC(CN1CCCC1(C)C)(C(N)=O)c1ccccc1.
What is the InChIKey of 3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide?
The InChIKey is FQXCUJXGENIJAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-4-19-17(15(18)21,14-9-6-5-7-10-14)13-20-12-8-11-16(20,2)3/h5-7,9-10,19H,4,8,11-13H2,1-3H3,(H2,18,21).
What are the key properties of 3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide?
3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide has a molecular weight of 289.42 g/mol, XLogP of 1.85, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-dimethylpyrrolidin-1-yl)-2-(ethylamino)-2-phenylpropanamide is sourced from PubChem (CID 63217523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).