1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide

C10H19N3O2 — CID 106318154

IUPAC1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide
SMILESCNC(=O)C1(C)CCN(C(=O)C(C)N)C1
InChIInChI=1S/C10H19N3O2/c1-7(11)8(14)13-5-4-10(2,6-13)9(15)12-3/h7H,4-6,11H2,1-3H3,(H,12,15)
InChIKeyLHGSYCXMGAUVDF-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.68
Rot. Bonds2

About 1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide

1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide (PubChem CID 106318154) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide
PubChem CID106318154
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide
SMILESCNC(=O)C1(C)CCN(C(=O)C(C)N)C1
InChIInChI=1S/C10H19N3O2/c1-7(11)8(14)13-5-4-10(2,6-13)9(15)12-3/h7H,4-6,11H2,1-3H3,(H,12,15)
InChIKeyLHGSYCXMGAUVDF-UHFFFAOYSA-N
XLogP-0.68
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-aminopentanoyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318225
1-(3-chloro-2-methylpropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106317997
1-[2-(N'-hydroxycarbamimidoyl)-3-methylbutanoyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 106321120
1-(2-aminoacetyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318155
1-N,1-N,3-N,3-tetramethylpyrrolidine-1,3-dicarboxamide
CID 106132532
1-[2-amino-2-(4-methylphenyl)acetyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318151
1-(2-amino-5-methoxypentanoyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318300
1-(2-hydroxy-2-methylpropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318601
2-amino-1-(3-hydroxy-3-methylpyrrolidin-1-yl)propan-1-one
CID 103355859
N,3-dimethyl-1-(2,2,2-trifluoroacetyl)pyrrolidine-3-carboxamide
CID 106322158
1-(3-amino-2,2,3-trimethylbutanoyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106318267
2-amino-3-[3-methyl-3-(methylcarbamoyl)pyrrolidin-1-yl]propanoic acid
CID 106318954

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide?
The IUPAC name of 1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide (CID 106318154) is 1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide?
The canonical SMILES for 1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide is CNC(=O)C1(C)CCN(C(=O)C(C)N)C1.
What is the InChIKey of 1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide?
The InChIKey is LHGSYCXMGAUVDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-7(11)8(14)13-5-4-10(2,6-13)9(15)12-3/h7H,4-6,11H2,1-3H3,(H,12,15).
What are the key properties of 1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide?
1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide has a molecular weight of 213.28 g/mol, XLogP of -0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminopropanoyl)-N,3-dimethylpyrrolidine-3-carboxamide is sourced from PubChem (CID 106318154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).