2-[acetyl(methyl)amino]-N-dodecylacetamide

C17H34N2O2 — CID 154143762

IUPAC2-[acetyl(methyl)amino]-N-dodecylacetamide
SMILESCCCCCCCCCCCCNC(=O)CN(C)C(C)=O
InChIInChI=1S/C17H34N2O2/c1-4-5-6-7-8-9-10-11-12-13-14-18-17(21)15-19(3)16(2)20/h4-15H2,1-3H3,(H,18,21)
InChIKeyAWBFBTNZEWVDCQ-UHFFFAOYSA-N
MW298.47 g/mol
LogP3.50
Rot. Bonds13

About 2-[acetyl(methyl)amino]-N-dodecylacetamide

2-[acetyl(methyl)amino]-N-dodecylacetamide (PubChem CID 154143762) has the molecular formula C17H34N2O2 and a molecular weight of 298.47 g/mol. Its IUPAC name is 2-[acetyl(methyl)amino]-N-dodecylacetamide.

Molecular Properties

Compound Name2-[acetyl(methyl)amino]-N-dodecylacetamide
PubChem CID154143762
Molecular FormulaC17H34N2O2
Molecular Weight298.47 g/mol
Exact Mass298.26
IUPAC Name2-[acetyl(methyl)amino]-N-dodecylacetamide
SMILESCCCCCCCCCCCCNC(=O)CN(C)C(C)=O
InChIInChI=1S/C17H34N2O2/c1-4-5-6-7-8-9-10-11-12-13-14-18-17(21)15-19(3)16(2)20/h4-15H2,1-3H3,(H,18,21)
InChIKeyAWBFBTNZEWVDCQ-UHFFFAOYSA-N
XLogP3.50
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 53.50
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-[acetyl(methyl)amino]-N-hexylacetamide
CID 71897485
2-(dimethylamino)-N-octadecylacetamide;ethane
CID 90860669
4-[[2-[acetyl(methyl)amino]acetyl]amino]butanoic acid
CID 43355054
[3-[[2-[[2-[[2-[[2-[[2-(hexylamino)-2-oxoethyl]-methylamino]-2-oxoethyl]-methylamino]-2-oxoethyl]-methylamino]-2-oxoethyl]-methylamino]-2-oxoethyl]-methylamino]-3-oxopropyl]azanide;rubidium(1+)
CID 171639523
2-[2-[[2-(hexadecylamino)-2-oxoethyl]-methylamino]ethyl-methylamino]acetic acid
CID 171721073
N-decyl-2-[2-[di(nonyl)amino]ethyl-nonylamino]acetamide
CID 137363672
5-[[2-[acetyl(methyl)amino]acetyl]amino]-2-methylpentanoic acid
CID 104681859
N-[8-(dodecanoylamino)octyl]dodecanamide
CID 3273664
N-[6-(pentadecanoylamino)hexyl]pentadecanamide
CID 102117556
N-pentylicosanamide
CID 139961886
N-[12-(decanoylamino)dodecyl]decanamide
CID 142735988
N-[4-(docosanoylamino)butyl]docosanamide
CID 87333313

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(methyl)amino]-N-dodecylacetamide?
The IUPAC name of 2-[acetyl(methyl)amino]-N-dodecylacetamide (CID 154143762) is 2-[acetyl(methyl)amino]-N-dodecylacetamide.
What is the SMILES notation for 2-[acetyl(methyl)amino]-N-dodecylacetamide?
The canonical SMILES for 2-[acetyl(methyl)amino]-N-dodecylacetamide is CCCCCCCCCCCCNC(=O)CN(C)C(C)=O.
What is the InChIKey of 2-[acetyl(methyl)amino]-N-dodecylacetamide?
The InChIKey is AWBFBTNZEWVDCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O2/c1-4-5-6-7-8-9-10-11-12-13-14-18-17(21)15-19(3)16(2)20/h4-15H2,1-3H3,(H,18,21).
What are the key properties of 2-[acetyl(methyl)amino]-N-dodecylacetamide?
2-[acetyl(methyl)amino]-N-dodecylacetamide has a molecular weight of 298.47 g/mol, XLogP of 3.50, 13 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(methyl)amino]-N-dodecylacetamide is sourced from PubChem (CID 154143762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).