9-methyl-8-oxodecanamide

C11H21NO2 — CID 168891746

IUPAC9-methyl-8-oxodecanamide
SMILESCC(C)C(=O)CCCCCCC(N)=O
InChIInChI=1S/C11H21NO2/c1-9(2)10(13)7-5-3-4-6-8-11(12)14/h9H,3-8H2,1-2H3,(H2,12,14)
InChIKeyWNZAFQBJUQHQCX-UHFFFAOYSA-N
MW199.29 g/mol
LogP2.04
Rot. Bonds8

About 9-methyl-8-oxodecanamide

9-methyl-8-oxodecanamide (PubChem CID 168891746) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 9-methyl-8-oxodecanamide.

Molecular Properties

Compound Name9-methyl-8-oxodecanamide
PubChem CID168891746
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name9-methyl-8-oxodecanamide
SMILESCC(C)C(=O)CCCCCCC(N)=O
InChIInChI=1S/C11H21NO2/c1-9(2)10(13)7-5-3-4-6-8-11(12)14/h9H,3-8H2,1-2H3,(H2,12,14)
InChIKeyWNZAFQBJUQHQCX-UHFFFAOYSA-N
XLogP2.04
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

14-methylpentadecane-2,13-dione
CID 88544438
2-methylhexadecan-3-one
CID 58030381
docosanediamide;hexacosanediamide
CID 129179979
dodecanediamide;nonanediamide
CID 175017820
nonatetracontanediamide
CID 162734608
pentadecanediamide
CID 87429217
12-methyltridecane-3,4,11-trione
CID 22953560
2,19-dimethylhenicosane-3,18-dione
CID 138498522
21-methyldotetracontanediamide
CID 87333254
2-methyl-2-(7-methyl-6-oxooctoxy)propanamide
CID 163841187
copper;tridecanediamide
CID 159780260
2,8-dimethylnon-8-en-3-one
CID 114477246

Frequently Asked Questions

What is the IUPAC name of 9-methyl-8-oxodecanamide?
The IUPAC name of 9-methyl-8-oxodecanamide (CID 168891746) is 9-methyl-8-oxodecanamide.
What is the SMILES notation for 9-methyl-8-oxodecanamide?
The canonical SMILES for 9-methyl-8-oxodecanamide is CC(C)C(=O)CCCCCCC(N)=O.
What is the InChIKey of 9-methyl-8-oxodecanamide?
The InChIKey is WNZAFQBJUQHQCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-9(2)10(13)7-5-3-4-6-8-11(12)14/h9H,3-8H2,1-2H3,(H2,12,14).
What are the key properties of 9-methyl-8-oxodecanamide?
9-methyl-8-oxodecanamide has a molecular weight of 199.29 g/mol, XLogP of 2.04, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-8-oxodecanamide is sourced from PubChem (CID 168891746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).