2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide

C16H25N3O — CID 83220952

IUPAC2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide
SMILESCCC1CCC(C)N1CC(N)(C(N)=O)c1ccccc1
InChIInChI=1S/C16H25N3O/c1-3-14-10-9-12(2)19(14)11-16(18,15(17)20)13-7-5-4-6-8-13/h4-8,12,14H,3,9-11,18H2,1-2H3,(H2,17,20)
InChIKeyJYZCLUFZCPSHKP-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.59
Rot. Bonds5

About 2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide

2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide (PubChem CID 83220952) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide
PubChem CID83220952
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide
SMILESCCC1CCC(C)N1CC(N)(C(N)=O)c1ccccc1
InChIInChI=1S/C16H25N3O/c1-3-14-10-9-12(2)19(14)11-16(18,15(17)20)13-7-5-4-6-8-13/h4-8,12,14H,3,9-11,18H2,1-2H3,(H2,17,20)
InChIKeyJYZCLUFZCPSHKP-UHFFFAOYSA-N
XLogP1.59
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methyl-2-phenylpropanoic acid
CID 83221625
2-amino-4-(3-ethylpyrrolidin-1-yl)-2-phenylbutanamide
CID 116693918
2-amino-4-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methylbutanoic acid
CID 83221596
2-cyclopropyl-2-(ethylamino)-3-(2-ethyl-5-methylpyrrolidin-1-yl)propanamide
CID 83221428
benzyl 3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methylpropanoate
CID 106484384
2-amino-4-(4-ethylpiperazin-1-yl)-2-phenylbutanamide
CID 116693503
2-cyclopropyl-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(propylamino)propanamide
CID 83221829
1-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methylpropan-2-ol
CID 83224284
2-amino-4-(2-ethyl-5-methylpyrrolidin-1-yl)butanoic acid
CID 83221433
1-(2-bromophenyl)-2-(2-ethyl-5-methylpyrrolidin-1-yl)ethanone
CID 83220282
2-(2-ethyl-5-methylpyrrolidin-1-yl)-1-(2-fluorophenyl)ethanone
CID 83220278
2-[2-(2-ethyl-5-methylpyrrolidin-1-yl)ethoxy]benzenecarbothioamide
CID 83227479

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide?
The IUPAC name of 2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide (CID 83220952) is 2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide.
What is the SMILES notation for 2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide?
The canonical SMILES for 2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide is CCC1CCC(C)N1CC(N)(C(N)=O)c1ccccc1.
What is the InChIKey of 2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide?
The InChIKey is JYZCLUFZCPSHKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-3-14-10-9-12(2)19(14)11-16(18,15(17)20)13-7-5-4-6-8-13/h4-8,12,14H,3,9-11,18H2,1-2H3,(H2,17,20).
What are the key properties of 2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide?
2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide has a molecular weight of 275.40 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-phenylpropanamide is sourced from PubChem (CID 83220952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).