10,10-dimethyl-N-(2-methylpropyl)undecanamide

C17H35NO — CID 19922139

IUPAC10,10-dimethyl-N-(2-methylpropyl)undecanamide
SMILESCC(C)CNC(=O)CCCCCCCCC(C)(C)C
InChIInChI=1S/C17H35NO/c1-15(2)14-18-16(19)12-10-8-6-7-9-11-13-17(3,4)5/h15H,6-14H2,1-5H3,(H,18,19)
InChIKeyIBFOBTVXCDFNBI-UHFFFAOYSA-N
MW269.47 g/mol
LogP4.93
Rot. Bonds10

About 10,10-dimethyl-N-(2-methylpropyl)undecanamide

10,10-dimethyl-N-(2-methylpropyl)undecanamide (PubChem CID 19922139) has the molecular formula C17H35NO and a molecular weight of 269.47 g/mol. Its IUPAC name is 10,10-dimethyl-N-(2-methylpropyl)undecanamide.

Molecular Properties

Compound Name10,10-dimethyl-N-(2-methylpropyl)undecanamide
PubChem CID19922139
Molecular FormulaC17H35NO
Molecular Weight269.47 g/mol
Exact Mass269.27
IUPAC Name10,10-dimethyl-N-(2-methylpropyl)undecanamide
SMILESCC(C)CNC(=O)CCCCCCCCC(C)(C)C
InChIInChI=1S/C17H35NO/c1-15(2)14-18-16(19)12-10-8-6-7-9-11-13-17(3,4)5/h15H,6-14H2,1-5H3,(H,18,19)
InChIKeyIBFOBTVXCDFNBI-UHFFFAOYSA-N
XLogP4.93
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.47
LogP ≤ 54.93
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 10,10-dimethyl-N-(2-methylpropyl)undecanamide?
The IUPAC name of 10,10-dimethyl-N-(2-methylpropyl)undecanamide (CID 19922139) is 10,10-dimethyl-N-(2-methylpropyl)undecanamide.
What is the SMILES notation for 10,10-dimethyl-N-(2-methylpropyl)undecanamide?
The canonical SMILES for 10,10-dimethyl-N-(2-methylpropyl)undecanamide is CC(C)CNC(=O)CCCCCCCCC(C)(C)C.
What is the InChIKey of 10,10-dimethyl-N-(2-methylpropyl)undecanamide?
The InChIKey is IBFOBTVXCDFNBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35NO/c1-15(2)14-18-16(19)12-10-8-6-7-9-11-13-17(3,4)5/h15H,6-14H2,1-5H3,(H,18,19).
What are the key properties of 10,10-dimethyl-N-(2-methylpropyl)undecanamide?
10,10-dimethyl-N-(2-methylpropyl)undecanamide has a molecular weight of 269.47 g/mol, XLogP of 4.93, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10-dimethyl-N-(2-methylpropyl)undecanamide is sourced from PubChem (CID 19922139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).