N,2-dimethyl-5-oxopentanamide

C7H13NO2 — CID 20693317

IUPACN,2-dimethyl-5-oxopentanamide
SMILESCNC(=O)C(C)CCC=O
InChIInChI=1S/C7H13NO2/c1-6(4-3-5-9)7(10)8-2/h5-6H,3-4H2,1-2H3,(H,8,10)
InChIKeyINTXXVABFLAWAE-UHFFFAOYSA-N
MW143.19 g/mol
LogP0.35
Rot. Bonds4

About N,2-dimethyl-5-oxopentanamide

N,2-dimethyl-5-oxopentanamide (PubChem CID 20693317) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is N,2-dimethyl-5-oxopentanamide.

Molecular Properties

Compound NameN,2-dimethyl-5-oxopentanamide
PubChem CID20693317
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC NameN,2-dimethyl-5-oxopentanamide
SMILESCNC(=O)C(C)CCC=O
InChIInChI=1S/C7H13NO2/c1-6(4-3-5-9)7(10)8-2/h5-6H,3-4H2,1-2H3,(H,8,10)
InChIKeyINTXXVABFLAWAE-UHFFFAOYSA-N
XLogP0.35
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-ethyl-N-methyl-5-oxopentanamide
CID 145371597
N,2,5-trimethylhexanamide
CID 78065622
N-methyl-2-(3-oxopropyl)pent-4-enamide
CID 142360160
2-[formyl(methyl)amino]-N-methyl-5-oxopentanamide
CID 142365578
4,7-dimethyl-5-oxooctanal
CID 57274522
4-methyl-5-(methylamino)-5-oxopentanoyl fluoride
CID 20695613
2-anilino-N-methyl-5-oxopentanamide;ethylphosphane
CID 170749132
(2S)-3-hydroxy-N,2-dimethylpropanamide
CID 58246856
ethyl (2S)-2-(methylamino)-5-oxopentanoate
CID 90464731
N,2-dimethylpentanediamide;ethane
CID 145111022
ethyl 2-methyl-5-oxopentanoate
CID 57121376
N,2-dimethyl-6-(methylamino)hexanamide
CID 153084375

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-5-oxopentanamide?
The IUPAC name of N,2-dimethyl-5-oxopentanamide (CID 20693317) is N,2-dimethyl-5-oxopentanamide.
What is the SMILES notation for N,2-dimethyl-5-oxopentanamide?
The canonical SMILES for N,2-dimethyl-5-oxopentanamide is CNC(=O)C(C)CCC=O.
What is the InChIKey of N,2-dimethyl-5-oxopentanamide?
The InChIKey is INTXXVABFLAWAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-6(4-3-5-9)7(10)8-2/h5-6H,3-4H2,1-2H3,(H,8,10).
What are the key properties of N,2-dimethyl-5-oxopentanamide?
N,2-dimethyl-5-oxopentanamide has a molecular weight of 143.19 g/mol, XLogP of 0.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-5-oxopentanamide is sourced from PubChem (CID 20693317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).