2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide

C12H25N3O2 — CID 54916217

IUPAC2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide
SMILESCCCC(N)C(=O)N(CCC)CC(=O)N(C)C
InChIInChI=1S/C12H25N3O2/c1-5-7-10(13)12(17)15(8-6-2)9-11(16)14(3)4/h10H,5-9,13H2,1-4H3
InChIKeyYAEGQFIONHUIOO-UHFFFAOYSA-N
MW243.35 g/mol
LogP0.44
Rot. Bonds7

About 2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide

2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide (PubChem CID 54916217) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide.

Molecular Properties

Compound Name2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide
PubChem CID54916217
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide
SMILESCCCC(N)C(=O)N(CCC)CC(=O)N(C)C
InChIInChI=1S/C12H25N3O2/c1-5-7-10(13)12(17)15(8-6-2)9-11(16)14(3)4/h10H,5-9,13H2,1-4H3
InChIKeyYAEGQFIONHUIOO-UHFFFAOYSA-N
XLogP0.44
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylbutanamide
CID 79023216
3-amino-4-[[2-(dimethylamino)-2-oxoethyl]-propylamino]-4-oxobutanoic acid
CID 64894953
(2S)-2-amino-N-[2-(dimethylamino)-2-oxoethyl]-4-methyl-N-propylpentanamide
CID 61158178
2-amino-N-[2-(dimethylamino)-2-oxoethyl]-3-methoxy-N-propylpropanamide
CID 81088934
(2S)-2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylpentanamide
CID 107568202
2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-ethylbutanamide
CID 43649681
2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylacetamide
CID 61042597
(2R)-2-amino-N,N-dibutylpentanamide
CID 103793770
(2R)-2-amino-N,N-dipentylpentanamide
CID 93372351
(2S)-2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)-4-methylsulfanylbutanamide
CID 61165462
N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide
CID 79202204
(2R)-2-amino-N-hydroxy-N-methylpentanamide
CID 131057070

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide?
The IUPAC name of 2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide (CID 54916217) is 2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide.
What is the SMILES notation for 2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide?
The canonical SMILES for 2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide is CCCC(N)C(=O)N(CCC)CC(=O)N(C)C.
What is the InChIKey of 2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide?
The InChIKey is YAEGQFIONHUIOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-5-7-10(13)12(17)15(8-6-2)9-11(16)14(3)4/h10H,5-9,13H2,1-4H3.
What are the key properties of 2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide?
2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide has a molecular weight of 243.35 g/mol, XLogP of 0.44, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-propylpentanamide is sourced from PubChem (CID 54916217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).