2-(dimethylamino)-4-methylpentanamide

C8H18N2O — CID 116914704

IUPAC2-(dimethylamino)-4-methylpentanamide
SMILESCC(C)CC(C(N)=O)N(C)C
InChIInChI=1S/C8H18N2O/c1-6(2)5-7(8(9)11)10(3)4/h6-7H,5H2,1-4H3,(H2,9,11)
InChIKeyPMOIPBAKOCMRTO-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.45
Rot. Bonds4

About 2-(dimethylamino)-4-methylpentanamide

2-(dimethylamino)-4-methylpentanamide (PubChem CID 116914704) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 2-(dimethylamino)-4-methylpentanamide.

Molecular Properties

Compound Name2-(dimethylamino)-4-methylpentanamide
PubChem CID116914704
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name2-(dimethylamino)-4-methylpentanamide
SMILESCC(C)CC(C(N)=O)N(C)C
InChIInChI=1S/C8H18N2O/c1-6(2)5-7(8(9)11)10(3)4/h6-7H,5H2,1-4H3,(H2,9,11)
InChIKeyPMOIPBAKOCMRTO-UHFFFAOYSA-N
XLogP0.45
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-4-methylpentanamide?
The IUPAC name of 2-(dimethylamino)-4-methylpentanamide (CID 116914704) is 2-(dimethylamino)-4-methylpentanamide.
What is the SMILES notation for 2-(dimethylamino)-4-methylpentanamide?
The canonical SMILES for 2-(dimethylamino)-4-methylpentanamide is CC(C)CC(C(N)=O)N(C)C.
What is the InChIKey of 2-(dimethylamino)-4-methylpentanamide?
The InChIKey is PMOIPBAKOCMRTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-6(2)5-7(8(9)11)10(3)4/h6-7H,5H2,1-4H3,(H2,9,11).
What are the key properties of 2-(dimethylamino)-4-methylpentanamide?
2-(dimethylamino)-4-methylpentanamide has a molecular weight of 158.24 g/mol, XLogP of 0.45, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-4-methylpentanamide is sourced from PubChem (CID 116914704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).