N,4-dimethylpentanamide

C7H15NO — CID 20533276

IUPACN,4-dimethylpentanamide
SMILESCNC(=O)CCC(C)C
InChIInChI=1S/C7H15NO/c1-6(2)4-5-7(9)8-3/h6H,4-5H2,1-3H3,(H,8,9)
InChIKeySXFWBOTXORQGJN-UHFFFAOYSA-N
MW129.20 g/mol
LogP1.17
Rot. Bonds3

About N,4-dimethylpentanamide

N,4-dimethylpentanamide (PubChem CID 20533276) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is N,4-dimethylpentanamide.

Molecular Properties

Compound NameN,4-dimethylpentanamide
PubChem CID20533276
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC NameN,4-dimethylpentanamide
SMILESCNC(=O)CCC(C)C
InChIInChI=1S/C7H15NO/c1-6(2)4-5-7(9)8-3/h6H,4-5H2,1-3H3,(H,8,9)
InChIKeySXFWBOTXORQGJN-UHFFFAOYSA-N
XLogP1.17
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,4-dimethylpentanamide?
The IUPAC name of N,4-dimethylpentanamide (CID 20533276) is N,4-dimethylpentanamide.
What is the SMILES notation for N,4-dimethylpentanamide?
The canonical SMILES for N,4-dimethylpentanamide is CNC(=O)CCC(C)C.
What is the InChIKey of N,4-dimethylpentanamide?
The InChIKey is SXFWBOTXORQGJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO/c1-6(2)4-5-7(9)8-3/h6H,4-5H2,1-3H3,(H,8,9).
What are the key properties of N,4-dimethylpentanamide?
N,4-dimethylpentanamide has a molecular weight of 129.20 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethylpentanamide is sourced from PubChem (CID 20533276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).