N-decyl-N-methylacetamide

C13H27NO — CID 22114742

IUPACN-decyl-N-methylacetamide
SMILESCCCCCCCCCCN(C)C(C)=O
InChIInChI=1S/C13H27NO/c1-4-5-6-7-8-9-10-11-12-14(3)13(2)15/h4-12H2,1-3H3
InChIKeyCYNVUJUGSNXQQQ-UHFFFAOYSA-N
MW213.36 g/mol
LogP3.61
Rot. Bonds9

About N-decyl-N-methylacetamide

N-decyl-N-methylacetamide (PubChem CID 22114742) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is N-decyl-N-methylacetamide.

Molecular Properties

Compound NameN-decyl-N-methylacetamide
PubChem CID22114742
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC NameN-decyl-N-methylacetamide
SMILESCCCCCCCCCCN(C)C(C)=O
InChIInChI=1S/C13H27NO/c1-4-5-6-7-8-9-10-11-12-14(3)13(2)15/h4-12H2,1-3H3
InChIKeyCYNVUJUGSNXQQQ-UHFFFAOYSA-N
XLogP3.61
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 53.61
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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Related Compounds

ethane;N-methyl-N-octylacetamide
CID 142531459
N-butyl-N-methylacetamide;ethane
CID 142088805
N-[2-[heptadecyl(methyl)amino]ethyl]-N-methylacetamide
CID 10714096
hexadecyl(methyl)carbamic acid
CID 15173799
N-methyl-N-propylacetamide;octadecanamide
CID 174331077
N-hexyl-N-methylcarbamoyl chloride
CID 23509235
N,2-dimethyl-N-tetracosylprop-2-enamide
CID 87262023
N-[5-(butylamino)pentyl]-N-methylacetamide;ethane;molecular hydrogen;propane
CID 167519800
N,N-di(icosyl)acetamide
CID 57063838
N-acetyl-N-decylacetamide
CID 57029087
N-heptadecyl-N-tridecylacetamide
CID 172567567
N,N-di(pentadecyl)acetamide
CID 174726671

Frequently Asked Questions

What is the IUPAC name of N-decyl-N-methylacetamide?
The IUPAC name of N-decyl-N-methylacetamide (CID 22114742) is N-decyl-N-methylacetamide.
What is the SMILES notation for N-decyl-N-methylacetamide?
The canonical SMILES for N-decyl-N-methylacetamide is CCCCCCCCCCN(C)C(C)=O.
What is the InChIKey of N-decyl-N-methylacetamide?
The InChIKey is CYNVUJUGSNXQQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-4-5-6-7-8-9-10-11-12-14(3)13(2)15/h4-12H2,1-3H3.
What are the key properties of N-decyl-N-methylacetamide?
N-decyl-N-methylacetamide has a molecular weight of 213.36 g/mol, XLogP of 3.61, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-decyl-N-methylacetamide is sourced from PubChem (CID 22114742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).