2-ethyl-3-methylpentanamide

C8H17NO — CID 20140

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IUPAC2-ethyl-3-methylpentanamide
SMILESCCC(C)C(CC)C(N)=O
InChIInChI=1S/C8H17NO/c1-4-6(3)7(5-2)8(9)10/h6-7H,4-5H2,1-3H3,(H2,9,10)
InChIKeyQRCJOCOSPZMDJY-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.54
Rot. Bonds4

About 2-ethyl-3-methylpentanamide

2-ethyl-3-methylpentanamide (PubChem CID 20140) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 2-ethyl-3-methylpentanamide.

Molecular Properties

Compound Name2-ethyl-3-methylpentanamide
PubChem CID20140
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name2-ethyl-3-methylpentanamide
SMILESCCC(C)C(CC)C(N)=O
InChIInChI=1S/C8H17NO/c1-4-6(3)7(5-2)8(9)10/h6-7H,4-5H2,1-3H3,(H2,9,10)
InChIKeyQRCJOCOSPZMDJY-UHFFFAOYSA-N
XLogP1.54
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-methylpentanamide?
The IUPAC name of 2-ethyl-3-methylpentanamide (CID 20140) is 2-ethyl-3-methylpentanamide.
What is the SMILES notation for 2-ethyl-3-methylpentanamide?
The canonical SMILES for 2-ethyl-3-methylpentanamide is CCC(C)C(CC)C(N)=O.
What is the InChIKey of 2-ethyl-3-methylpentanamide?
The InChIKey is QRCJOCOSPZMDJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-4-6(3)7(5-2)8(9)10/h6-7H,4-5H2,1-3H3,(H2,9,10).
What are the key properties of 2-ethyl-3-methylpentanamide?
2-ethyl-3-methylpentanamide has a molecular weight of 143.23 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-methylpentanamide is sourced from PubChem (CID 20140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).