N-benzyl-N-methyldecanamide

C18H29NO — CID 11300336

IUPACN-benzyl-N-methyldecanamide
SMILESCCCCCCCCCC(=O)N(C)Cc1ccccc1
InChIInChI=1S/C18H29NO/c1-3-4-5-6-7-8-12-15-18(20)19(2)16-17-13-10-9-11-14-17/h9-11,13-14H,3-8,12,15-16H2,1-2H3
InChIKeyREIQCTLIRAIYEX-UHFFFAOYSA-N
MW275.44 g/mol
LogP4.79
Rot. Bonds10

About N-benzyl-N-methyldecanamide

N-benzyl-N-methyldecanamide (PubChem CID 11300336) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is N-benzyl-N-methyldecanamide.

Molecular Properties

Compound NameN-benzyl-N-methyldecanamide
PubChem CID11300336
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC NameN-benzyl-N-methyldecanamide
SMILESCCCCCCCCCC(=O)N(C)Cc1ccccc1
InChIInChI=1S/C18H29NO/c1-3-4-5-6-7-8-12-15-18(20)19(2)16-17-13-10-9-11-14-17/h9-11,13-14H,3-8,12,15-16H2,1-2H3
InChIKeyREIQCTLIRAIYEX-UHFFFAOYSA-N
XLogP4.79
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 54.79
H-Bond Donors ≤ 50
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 N-benzyl-N-methyldecanamide?
The IUPAC name of N-benzyl-N-methyldecanamide (CID 11300336) is N-benzyl-N-methyldecanamide.
What is the SMILES notation for N-benzyl-N-methyldecanamide?
The canonical SMILES for N-benzyl-N-methyldecanamide is CCCCCCCCCC(=O)N(C)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-methyldecanamide?
The InChIKey is REIQCTLIRAIYEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-3-4-5-6-7-8-12-15-18(20)19(2)16-17-13-10-9-11-14-17/h9-11,13-14H,3-8,12,15-16H2,1-2H3.
What are the key properties of N-benzyl-N-methyldecanamide?
N-benzyl-N-methyldecanamide has a molecular weight of 275.44 g/mol, XLogP of 4.79, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyldecanamide is sourced from PubChem (CID 11300336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).