8-methylnonanamide

C10H21NO — CID 20558424

IUPAC8-methylnonanamide
SMILESCC(C)CCCCCCC(N)=O
InChIInChI=1S/C10H21NO/c1-9(2)7-5-3-4-6-8-10(11)12/h9H,3-8H2,1-2H3,(H2,11,12)
InChIKeyRQTJHIZCVWJGDM-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.47
Rot. Bonds7

About 8-methylnonanamide

8-methylnonanamide (PubChem CID 20558424) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 8-methylnonanamide.

Molecular Properties

Compound Name8-methylnonanamide
PubChem CID20558424
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name8-methylnonanamide
SMILESCC(C)CCCCCCC(N)=O
InChIInChI=1S/C10H21NO/c1-9(2)7-5-3-4-6-8-10(11)12/h9H,3-8H2,1-2H3,(H2,11,12)
InChIKeyRQTJHIZCVWJGDM-UHFFFAOYSA-N
XLogP2.47
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 8-methylnonanamide?
The IUPAC name of 8-methylnonanamide (CID 20558424) is 8-methylnonanamide.
What is the SMILES notation for 8-methylnonanamide?
The canonical SMILES for 8-methylnonanamide is CC(C)CCCCCCC(N)=O.
What is the InChIKey of 8-methylnonanamide?
The InChIKey is RQTJHIZCVWJGDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-9(2)7-5-3-4-6-8-10(11)12/h9H,3-8H2,1-2H3,(H2,11,12).
What are the key properties of 8-methylnonanamide?
8-methylnonanamide has a molecular weight of 171.28 g/mol, XLogP of 2.47, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methylnonanamide is sourced from PubChem (CID 20558424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).