N-(methoxymethyl)hexadecanamide

C18H37NO2 — CID 59805196

IUPACN-(methoxymethyl)hexadecanamide
SMILESCCCCCCCCCCCCCCCC(=O)NCOC
InChIInChI=1S/C18H37NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(20)19-17-21-2/h3-17H2,1-2H3,(H,19,20)
InChIKeyTYFIAWSNBABKHC-UHFFFAOYSA-N
MW299.50 g/mol
LogP5.19
Rot. Bonds16

About N-(methoxymethyl)hexadecanamide

N-(methoxymethyl)hexadecanamide (PubChem CID 59805196) has the molecular formula C18H37NO2 and a molecular weight of 299.50 g/mol. Its IUPAC name is N-(methoxymethyl)hexadecanamide.

Molecular Properties

Compound NameN-(methoxymethyl)hexadecanamide
PubChem CID59805196
Molecular FormulaC18H37NO2
Molecular Weight299.50 g/mol
Exact Mass299.28
IUPAC NameN-(methoxymethyl)hexadecanamide
SMILESCCCCCCCCCCCCCCCC(=O)NCOC
InChIInChI=1S/C18H37NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(20)19-17-21-2/h3-17H2,1-2H3,(H,19,20)
InChIKeyTYFIAWSNBABKHC-UHFFFAOYSA-N
XLogP5.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.50
LogP ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N-ethylhexadecanamide
CID 18377756
N-[2-(heptadecanoylamino)ethyl]heptadecanamide
CID 22065407
N-ethyltridecanamide
CID 23297417
N-[(octadecanoylamino)methyl]tetracosanamide
CID 123600092
(hexanoylamino)methyl acetate
CID 20979306
6-(hexanoylamino)-N-(7-methoxyheptyl)hexanamide
CID 170966383
N-[(2S)-3-hydroxy-1-(methoxymethylamino)-1-oxopropan-2-yl]dodecanamide
CID 139696676
N-hexadecylhexanamide
CID 4953738
N-[4-(heptanoylamino)butyl]heptanamide
CID 3363703
N-(hydroxymethyl)henicosanamide
CID 102116485
N-dodecylhexanamide
CID 3362981
N,N'-dihexadecyldecanediamide
CID 17080069

Frequently Asked Questions

What is the IUPAC name of N-(methoxymethyl)hexadecanamide?
The IUPAC name of N-(methoxymethyl)hexadecanamide (CID 59805196) is N-(methoxymethyl)hexadecanamide.
What is the SMILES notation for N-(methoxymethyl)hexadecanamide?
The canonical SMILES for N-(methoxymethyl)hexadecanamide is CCCCCCCCCCCCCCCC(=O)NCOC.
What is the InChIKey of N-(methoxymethyl)hexadecanamide?
The InChIKey is TYFIAWSNBABKHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(20)19-17-21-2/h3-17H2,1-2H3,(H,19,20).
What are the key properties of N-(methoxymethyl)hexadecanamide?
N-(methoxymethyl)hexadecanamide has a molecular weight of 299.50 g/mol, XLogP of 5.19, 16 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methoxymethyl)hexadecanamide is sourced from PubChem (CID 59805196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).