N'-dodecyl-N,N-dimethylethanimidamide

C16H34N2 — CID 51354956

IUPACN'-dodecyl-N,N-dimethylethanimidamide
SMILESCCCCCCCCCCCC/N=C(\C)N(C)C
InChIInChI=1S/C16H34N2/c1-5-6-7-8-9-10-11-12-13-14-15-17-16(2)18(3)4/h5-15H2,1-4H3/b17-16+
InChIKeyIOLSVMXQZOYUCU-WUKNDPDISA-N
MW254.46 g/mol
LogP4.89
Rot. Bonds11

About N'-dodecyl-N,N-dimethylethanimidamide

N'-dodecyl-N,N-dimethylethanimidamide (PubChem CID 51354956) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is N'-dodecyl-N,N-dimethylethanimidamide.

Molecular Properties

Compound NameN'-dodecyl-N,N-dimethylethanimidamide
PubChem CID51354956
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC NameN'-dodecyl-N,N-dimethylethanimidamide
SMILESCCCCCCCCCCCC/N=C(\C)N(C)C
InChIInChI=1S/C16H34N2/c1-5-6-7-8-9-10-11-12-13-14-15-17-16(2)18(3)4/h5-15H2,1-4H3/b17-16+
InChIKeyIOLSVMXQZOYUCU-WUKNDPDISA-N
XLogP4.89
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 54.89
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'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-dodecyl-N,N-dimethylethanimidamide?
The IUPAC name of N'-dodecyl-N,N-dimethylethanimidamide (CID 51354956) is N'-dodecyl-N,N-dimethylethanimidamide.
What is the SMILES notation for N'-dodecyl-N,N-dimethylethanimidamide?
The canonical SMILES for N'-dodecyl-N,N-dimethylethanimidamide is CCCCCCCCCCCC/N=C(\C)N(C)C.
What is the InChIKey of N'-dodecyl-N,N-dimethylethanimidamide?
The InChIKey is IOLSVMXQZOYUCU-WUKNDPDISA-N. The full InChI is InChI=1S/C16H34N2/c1-5-6-7-8-9-10-11-12-13-14-15-17-16(2)18(3)4/h5-15H2,1-4H3/b17-16+.
What are the key properties of N'-dodecyl-N,N-dimethylethanimidamide?
N'-dodecyl-N,N-dimethylethanimidamide has a molecular weight of 254.46 g/mol, XLogP of 4.89, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-dodecyl-N,N-dimethylethanimidamide is sourced from PubChem (CID 51354956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).