2,4-dimethylpentanamide;N,2,4-trimethylpentanamide

C15H32N2O2 — CID 143544198

IUPAC2,4-dimethylpentanamide;N,2,4-trimethylpentanamide
SMILESCC(C)CC(C)C(N)=O.CNC(=O)C(C)CC(C)C
InChIInChI=1S/C8H17NO.C7H15NO/c1-6(2)5-7(3)8(10)9-4;1-5(2)4-6(3)7(8)9/h6-7H,5H2,1-4H3,(H,9,10);5-6H,4H2,1-3H3,(H2,8,9)
InChIKeyJOESIVCAORKTHF-UHFFFAOYSA-N
MW272.43 g/mol
LogP2.57
Rot. Bonds6

About 2,4-dimethylpentanamide;N,2,4-trimethylpentanamide

2,4-dimethylpentanamide;N,2,4-trimethylpentanamide (PubChem CID 143544198) has the molecular formula C15H32N2O2 and a molecular weight of 272.43 g/mol. Its IUPAC name is 2,4-dimethylpentanamide;N,2,4-trimethylpentanamide.

Molecular Properties

Compound Name2,4-dimethylpentanamide;N,2,4-trimethylpentanamide
PubChem CID143544198
Molecular FormulaC15H32N2O2
Molecular Weight272.43 g/mol
Exact Mass272.25
IUPAC Name2,4-dimethylpentanamide;N,2,4-trimethylpentanamide
SMILESCC(C)CC(C)C(N)=O.CNC(=O)C(C)CC(C)C
InChIInChI=1S/C8H17NO.C7H15NO/c1-6(2)5-7(3)8(10)9-4;1-5(2)4-6(3)7(8)9/h6-7H,5H2,1-4H3,(H,9,10);5-6H,4H2,1-3H3,(H2,8,9)
InChIKeyJOESIVCAORKTHF-UHFFFAOYSA-N
XLogP2.57
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylpentanamide;N,2,4-trimethylpentanamide?
The IUPAC name of 2,4-dimethylpentanamide;N,2,4-trimethylpentanamide (CID 143544198) is 2,4-dimethylpentanamide;N,2,4-trimethylpentanamide.
What is the SMILES notation for 2,4-dimethylpentanamide;N,2,4-trimethylpentanamide?
The canonical SMILES for 2,4-dimethylpentanamide;N,2,4-trimethylpentanamide is CC(C)CC(C)C(N)=O.CNC(=O)C(C)CC(C)C.
What is the InChIKey of 2,4-dimethylpentanamide;N,2,4-trimethylpentanamide?
The InChIKey is JOESIVCAORKTHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.C7H15NO/c1-6(2)5-7(3)8(10)9-4;1-5(2)4-6(3)7(8)9/h6-7H,5H2,1-4H3,(H,9,10);5-6H,4H2,1-3H3,(H2,8,9).
What are the key properties of 2,4-dimethylpentanamide;N,2,4-trimethylpentanamide?
2,4-dimethylpentanamide;N,2,4-trimethylpentanamide has a molecular weight of 272.43 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylpentanamide;N,2,4-trimethylpentanamide is sourced from PubChem (CID 143544198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).