N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide

C18H35NO2 — CID 166695144

IUPACN,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide
SMILESCC(C)CN(C)C(=O)CCCCCCCCC(=O)C(C)C
InChIInChI=1S/C18H35NO2/c1-15(2)14-19(5)18(21)13-11-9-7-6-8-10-12-17(20)16(3)4/h15-16H,6-14H2,1-5H3
InChIKeyWCLIXCUYAJIBRM-UHFFFAOYSA-N
MW297.48 g/mol
LogP4.45
Rot. Bonds12

About N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide

N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide (PubChem CID 166695144) has the molecular formula C18H35NO2 and a molecular weight of 297.48 g/mol. Its IUPAC name is N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide.

Molecular Properties

Compound NameN,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide
PubChem CID166695144
Molecular FormulaC18H35NO2
Molecular Weight297.48 g/mol
Exact Mass297.27
IUPAC NameN,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide
SMILESCC(C)CN(C)C(=O)CCCCCCCCC(=O)C(C)C
InChIInChI=1S/C18H35NO2/c1-15(2)14-19(5)18(21)13-11-9-7-6-8-10-12-17(20)16(3)4/h15-16H,6-14H2,1-5H3
InChIKeyWCLIXCUYAJIBRM-UHFFFAOYSA-N
XLogP4.45
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.48
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide?
The IUPAC name of N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide (CID 166695144) is N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide.
What is the SMILES notation for N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide?
The canonical SMILES for N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide is CC(C)CN(C)C(=O)CCCCCCCCC(=O)C(C)C.
What is the InChIKey of N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide?
The InChIKey is WCLIXCUYAJIBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO2/c1-15(2)14-19(5)18(21)13-11-9-7-6-8-10-12-17(20)16(3)4/h15-16H,6-14H2,1-5H3.
What are the key properties of N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide?
N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide has a molecular weight of 297.48 g/mol, XLogP of 4.45, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,11-dimethyl-N-(2-methylpropyl)-10-oxododecanamide is sourced from PubChem (CID 166695144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).