2-[dodecyl(methyl)amino]-N-methylacetamide

C16H34N2O — CID 87591465

IUPAC2-[dodecyl(methyl)amino]-N-methylacetamide
SMILESCCCCCCCCCCCCN(C)CC(=O)NC
InChIInChI=1S/C16H34N2O/c1-4-5-6-7-8-9-10-11-12-13-14-18(3)15-16(19)17-2/h4-15H2,1-3H3,(H,17,19)
InChIKeyXCEACMAVTLOQFX-UHFFFAOYSA-N
MW270.46 g/mol
LogP3.59
Rot. Bonds13

About 2-[dodecyl(methyl)amino]-N-methylacetamide

2-[dodecyl(methyl)amino]-N-methylacetamide (PubChem CID 87591465) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 2-[dodecyl(methyl)amino]-N-methylacetamide.

Molecular Properties

Compound Name2-[dodecyl(methyl)amino]-N-methylacetamide
PubChem CID87591465
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name2-[dodecyl(methyl)amino]-N-methylacetamide
SMILESCCCCCCCCCCCCN(C)CC(=O)NC
InChIInChI=1S/C16H34N2O/c1-4-5-6-7-8-9-10-11-12-13-14-18(3)15-16(19)17-2/h4-15H2,1-3H3,(H,17,19)
InChIKeyXCEACMAVTLOQFX-UHFFFAOYSA-N
XLogP3.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[butyl(methyl)amino]-N-methylacetamide
CID 123914364
decyl-[2-(methylamino)-2-oxoethyl]carbamic acid
CID 87240984
[2-(methylamino)-2-oxoethyl]-pentadecylcarbamic acid
CID 87240875
2-[4-aminobutyl(methyl)amino]-N-methylacetamide
CID 43374665
2-[hexyl(methyl)amino]acetic acid
CID 10197909
methyl 2-[methyl(nonyl)amino]acetate
CID 61238688
methyl 2-[methyl(octyl)amino]acetate
CID 62028594
2-[methyl(tridecyl)amino]acetamide
CID 175737609
N-methyl-8-[methyl(propyl)amino]octanamide
CID 88909699
calcium;2-[dodecyl(methyl)amino]acetic acid;hydride
CID 173195427
hexadec-9-enyl-[2-(methylamino)-2-oxoethyl]carbamic acid
CID 173040068
N,N-diethyl-2-[hexyl(methyl)amino]acetamide
CID 86911436

Frequently Asked Questions

What is the IUPAC name of 2-[dodecyl(methyl)amino]-N-methylacetamide?
The IUPAC name of 2-[dodecyl(methyl)amino]-N-methylacetamide (CID 87591465) is 2-[dodecyl(methyl)amino]-N-methylacetamide.
What is the SMILES notation for 2-[dodecyl(methyl)amino]-N-methylacetamide?
The canonical SMILES for 2-[dodecyl(methyl)amino]-N-methylacetamide is CCCCCCCCCCCCN(C)CC(=O)NC.
What is the InChIKey of 2-[dodecyl(methyl)amino]-N-methylacetamide?
The InChIKey is XCEACMAVTLOQFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-4-5-6-7-8-9-10-11-12-13-14-18(3)15-16(19)17-2/h4-15H2,1-3H3,(H,17,19).
What are the key properties of 2-[dodecyl(methyl)amino]-N-methylacetamide?
2-[dodecyl(methyl)amino]-N-methylacetamide has a molecular weight of 270.46 g/mol, XLogP of 3.59, 13 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[dodecyl(methyl)amino]-N-methylacetamide is sourced from PubChem (CID 87591465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).