N-methoxy-N-methyloctadecanamide

C20H41NO2 — CID 12743478

IUPACN-methoxy-N-methyloctadecanamide
SMILESCCCCCCCCCCCCCCCCCC(=O)N(C)OC
InChIInChI=1S/C20H41NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(22)21(2)23-3/h4-19H2,1-3H3
InChIKeyOZDAEBIGIATGPD-UHFFFAOYSA-N
MW327.55 g/mol
LogP6.27
Rot. Bonds17

About N-methoxy-N-methyloctadecanamide

N-methoxy-N-methyloctadecanamide (PubChem CID 12743478) has the molecular formula C20H41NO2 and a molecular weight of 327.55 g/mol. Its IUPAC name is N-methoxy-N-methyloctadecanamide.

Molecular Properties

Compound NameN-methoxy-N-methyloctadecanamide
PubChem CID12743478
Molecular FormulaC20H41NO2
Molecular Weight327.55 g/mol
Exact Mass327.31
IUPAC NameN-methoxy-N-methyloctadecanamide
SMILESCCCCCCCCCCCCCCCCCC(=O)N(C)OC
InChIInChI=1S/C20H41NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(22)21(2)23-3/h4-19H2,1-3H3
InChIKeyOZDAEBIGIATGPD-UHFFFAOYSA-N
XLogP6.27
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds17
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.55
LogP ≤ 56.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methyloctadecanamide?
The IUPAC name of N-methoxy-N-methyloctadecanamide (CID 12743478) is N-methoxy-N-methyloctadecanamide.
What is the SMILES notation for N-methoxy-N-methyloctadecanamide?
The canonical SMILES for N-methoxy-N-methyloctadecanamide is CCCCCCCCCCCCCCCCCC(=O)N(C)OC.
What is the InChIKey of N-methoxy-N-methyloctadecanamide?
The InChIKey is OZDAEBIGIATGPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H41NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(22)21(2)23-3/h4-19H2,1-3H3.
What are the key properties of N-methoxy-N-methyloctadecanamide?
N-methoxy-N-methyloctadecanamide has a molecular weight of 327.55 g/mol, XLogP of 6.27, 17 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyloctadecanamide is sourced from PubChem (CID 12743478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).