N,N,2-triethyl-4-methylpentanamide

C12H25NO — CID 170847895

IUPACN,N,2-triethyl-4-methylpentanamide
SMILESCCC(CC(C)C)C(=O)N(CC)CC
InChIInChI=1S/C12H25NO/c1-6-11(9-10(4)5)12(14)13(7-2)8-3/h10-11H,6-9H2,1-5H3
InChIKeyYOYSADPWTXEJDI-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.93
Rot. Bonds6

About N,N,2-triethyl-4-methylpentanamide

N,N,2-triethyl-4-methylpentanamide (PubChem CID 170847895) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is N,N,2-triethyl-4-methylpentanamide.

Molecular Properties

Compound NameN,N,2-triethyl-4-methylpentanamide
PubChem CID170847895
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC NameN,N,2-triethyl-4-methylpentanamide
SMILESCCC(CC(C)C)C(=O)N(CC)CC
InChIInChI=1S/C12H25NO/c1-6-11(9-10(4)5)12(14)13(7-2)8-3/h10-11H,6-9H2,1-5H3
InChIKeyYOYSADPWTXEJDI-UHFFFAOYSA-N
XLogP2.93
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N,2-triethyl-4-methylpentanamide?
The IUPAC name of N,N,2-triethyl-4-methylpentanamide (CID 170847895) is N,N,2-triethyl-4-methylpentanamide.
What is the SMILES notation for N,N,2-triethyl-4-methylpentanamide?
The canonical SMILES for N,N,2-triethyl-4-methylpentanamide is CCC(CC(C)C)C(=O)N(CC)CC.
What is the InChIKey of N,N,2-triethyl-4-methylpentanamide?
The InChIKey is YOYSADPWTXEJDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-6-11(9-10(4)5)12(14)13(7-2)8-3/h10-11H,6-9H2,1-5H3.
What are the key properties of N,N,2-triethyl-4-methylpentanamide?
N,N,2-triethyl-4-methylpentanamide has a molecular weight of 199.34 g/mol, XLogP of 2.93, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-triethyl-4-methylpentanamide is sourced from PubChem (CID 170847895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).