N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide

C10H18N2O3 — CID 106277105

IUPACN-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide
SMILESCC(=O)CCC(=O)NCC(C)(C)C(N)=O
InChIInChI=1S/C10H18N2O3/c1-7(13)4-5-8(14)12-6-10(2,3)9(11)15/h4-6H2,1-3H3,(H2,11,15)(H,12,14)
InChIKeyZGGDKCAPGOUIFB-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.02
Rot. Bonds6

About N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide

N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide (PubChem CID 106277105) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide
PubChem CID106277105
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC NameN-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide
SMILESCC(=O)CCC(=O)NCC(C)(C)C(N)=O
InChIInChI=1S/C10H18N2O3/c1-7(13)4-5-8(14)12-6-10(2,3)9(11)15/h4-6H2,1-3H3,(H2,11,15)(H,12,14)
InChIKeyZGGDKCAPGOUIFB-UHFFFAOYSA-N
XLogP-0.02
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-aminopropanoylamino)-2,2-dimethylpropanamide
CID 103795627
N-(3-amino-2,2-dimethyl-3-oxopropyl)hexanamide
CID 141198616
2,2-dimethyl-3-[[2-(methylamino)acetyl]amino]propanamide
CID 103809519
3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4,4-dimethylpentanamide
CID 114167246
2-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-2-oxoacetic acid
CID 104767621
3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2-dimethylpropanamide
CID 103809518
3-[[2-(4-aminophenyl)acetyl]amino]-2,2-dimethylpropanamide
CID 103809503
5-[(3-amino-2,2-dimethyl-3-oxopropyl)amino]-3-methyl-5-oxopentanoic acid
CID 106275549
2,2-dimethyl-3-(3-pyrrolidin-3-ylpropanoylamino)propanamide
CID 103859907
3-hydrazinyl-2,2-dimethylpropanamide
CID 134242033
3-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-2,2,3-trimethylbutanamide
CID 114167258
2,2-dimethyl-3-[3-(2-oxo-1-pyridinyl)propanoylamino]propanamide
CID 86996735

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide?
The IUPAC name of N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide (CID 106277105) is N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide.
What is the SMILES notation for N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide?
The canonical SMILES for N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide is CC(=O)CCC(=O)NCC(C)(C)C(N)=O.
What is the InChIKey of N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide?
The InChIKey is ZGGDKCAPGOUIFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-7(13)4-5-8(14)12-6-10(2,3)9(11)15/h4-6H2,1-3H3,(H2,11,15)(H,12,14).
What are the key properties of N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide?
N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide has a molecular weight of 214.26 g/mol, XLogP of -0.02, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-oxopentanamide is sourced from PubChem (CID 106277105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).