2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide

C9H19N3O2 — CID 43649658

IUPAC2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide
SMILESCCC(N)C(=O)NC(C)C(=O)N(C)C
InChIInChI=1S/C9H19N3O2/c1-5-7(10)8(13)11-6(2)9(14)12(3)4/h6-7H,5,10H2,1-4H3,(H,11,13)
InChIKeyWXJIRAZOFRWLGX-UHFFFAOYSA-N
MW201.27 g/mol
LogP-0.68
Rot. Bonds4

About 2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide

2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide (PubChem CID 43649658) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide.

Molecular Properties

Compound Name2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide
PubChem CID43649658
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC Name2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide
SMILESCCC(N)C(=O)NC(C)C(=O)N(C)C
InChIInChI=1S/C9H19N3O2/c1-5-7(10)8(13)11-6(2)9(14)12(3)4/h6-7H,5,10H2,1-4H3,(H,11,13)
InChIKeyWXJIRAZOFRWLGX-UHFFFAOYSA-N
XLogP-0.68
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]butanamide
CID 103109126
2-(2-aminobutanoylamino)-N,N,4-trimethylpentanamide
CID 43699936
2-amino-N-(1-amino-1-oxopropan-2-yl)butanamide
CID 43649626
2-amino-N,N-dimethylbutanamide
CID 43649466
(2R)-2-amino-N-[1-(dimethylamino)propan-2-yl]butanamide
CID 82945905
2-(2-chloropropanoylamino)-N,N-dimethylpropanamide
CID 43578901
(2R)-2-amino-N-[2-(dimethylcarbamoylamino)ethyl]butanamide
CID 83110467
(2S)-2-amino-N-(3-ethylpentan-2-yl)butanamide
CID 79023204
(2R)-2-amino-N-[(2R)-1-aminopropan-2-yl]butanamide
CID 131206927
(2R)-2-amino-N-(4-hydroxybutan-2-yl)butanamide
CID 83177321
(2S)-2-amino-N-[(2S)-1-oxopropan-2-yl]butanamide
CID 138857478
(2S)-2-amino-N-(4-methylpentan-2-yl)butanamide
CID 79025012

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide?
The IUPAC name of 2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide (CID 43649658) is 2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide.
What is the SMILES notation for 2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide?
The canonical SMILES for 2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide is CCC(N)C(=O)NC(C)C(=O)N(C)C.
What is the InChIKey of 2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide?
The InChIKey is WXJIRAZOFRWLGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-5-7(10)8(13)11-6(2)9(14)12(3)4/h6-7H,5,10H2,1-4H3,(H,11,13).
What are the key properties of 2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide?
2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide has a molecular weight of 201.27 g/mol, XLogP of -0.68, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]butanamide is sourced from PubChem (CID 43649658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).