N-(2-methylcyclohexylidene)dodecanamide

C19H35NO — CID 175121418

IUPACN-(2-methylcyclohexylidene)dodecanamide
SMILESCCCCCCCCCCCC(=O)/N=C1\CCCCC1C
InChIInChI=1S/C19H35NO/c1-3-4-5-6-7-8-9-10-11-16-19(21)20-18-15-13-12-14-17(18)2/h17H,3-16H2,1-2H3/b20-18+
InChIKeyCEDCEHTVYHAOFV-CZIZESTLSA-N
MW293.50 g/mol
LogP6.09
Rot. Bonds10

About N-(2-methylcyclohexylidene)dodecanamide

N-(2-methylcyclohexylidene)dodecanamide (PubChem CID 175121418) has the molecular formula C19H35NO and a molecular weight of 293.50 g/mol. Its IUPAC name is N-(2-methylcyclohexylidene)dodecanamide.

Molecular Properties

Compound NameN-(2-methylcyclohexylidene)dodecanamide
PubChem CID175121418
Molecular FormulaC19H35NO
Molecular Weight293.50 g/mol
Exact Mass293.27
IUPAC NameN-(2-methylcyclohexylidene)dodecanamide
SMILESCCCCCCCCCCCC(=O)/N=C1\CCCCC1C
InChIInChI=1S/C19H35NO/c1-3-4-5-6-7-8-9-10-11-16-19(21)20-18-15-13-12-14-17(18)2/h17H,3-16H2,1-2H3/b20-18+
InChIKeyCEDCEHTVYHAOFV-CZIZESTLSA-N
XLogP6.09
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.50
LogP ≤ 56.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N,N'-bis[(2-methylcyclohexylidene)amino]heptanediamide
CID 4657097
N-(4-octadecanoyliminocyclohexa-2,5-dien-1-ylidene)octadecanamide
CID 13437747
N-sulfanylideneoctanamide
CID 58219363
N-propylideneundecanamide
CID 90933467
1-cyclohexyldecan-1-one
CID 63409715
N-(2-dodecylcyclohexylidene)hydroxylamine
CID 2729436
2-tridecanoylcyclopentan-1-one
CID 59066894
N-oxotetradecanamide
CID 87730431
N-oxooctanamide
CID 87234486
[(1E)-3-methylcyclopentadecen-1-yl] dodecanoate
CID 68818540
1-cyclobutyldodecan-1-one
CID 115811550
1-(3-methylcyclohex-2-en-1-yl)heptan-1-one
CID 70961210

Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclohexylidene)dodecanamide?
The IUPAC name of N-(2-methylcyclohexylidene)dodecanamide (CID 175121418) is N-(2-methylcyclohexylidene)dodecanamide.
What is the SMILES notation for N-(2-methylcyclohexylidene)dodecanamide?
The canonical SMILES for N-(2-methylcyclohexylidene)dodecanamide is CCCCCCCCCCCC(=O)/N=C1\CCCCC1C.
What is the InChIKey of N-(2-methylcyclohexylidene)dodecanamide?
The InChIKey is CEDCEHTVYHAOFV-CZIZESTLSA-N. The full InChI is InChI=1S/C19H35NO/c1-3-4-5-6-7-8-9-10-11-16-19(21)20-18-15-13-12-14-17(18)2/h17H,3-16H2,1-2H3/b20-18+.
What are the key properties of N-(2-methylcyclohexylidene)dodecanamide?
N-(2-methylcyclohexylidene)dodecanamide has a molecular weight of 293.50 g/mol, XLogP of 6.09, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclohexylidene)dodecanamide is sourced from PubChem (CID 175121418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).