N'-decyl-N,N,2-trimethylpropanimidamide

C16H34N2 — CID 525900

IUPACN'-decyl-N,N,2-trimethylpropanimidamide
SMILESCCCCCCCCCC/N=C(\C(C)C)N(C)C
InChIInChI=1S/C16H34N2/c1-6-7-8-9-10-11-12-13-14-17-16(15(2)3)18(4)5/h15H,6-14H2,1-5H3/b17-16+
InChIKeyDLOAVHDDXIBZTA-WUKNDPDISA-N
MW254.46 g/mol
LogP4.74
Rot. Bonds10

About N'-decyl-N,N,2-trimethylpropanimidamide

N'-decyl-N,N,2-trimethylpropanimidamide (PubChem CID 525900) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is N'-decyl-N,N,2-trimethylpropanimidamide.

Molecular Properties

Compound NameN'-decyl-N,N,2-trimethylpropanimidamide
PubChem CID525900
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC NameN'-decyl-N,N,2-trimethylpropanimidamide
SMILESCCCCCCCCCC/N=C(\C(C)C)N(C)C
InChIInChI=1S/C16H34N2/c1-6-7-8-9-10-11-12-13-14-17-16(15(2)3)18(4)5/h15H,6-14H2,1-5H3/b17-16+
InChIKeyDLOAVHDDXIBZTA-WUKNDPDISA-N
XLogP4.74
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 54.74
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'-decyl-N,N,2-trimethylpropanimidamide?
The IUPAC name of N'-decyl-N,N,2-trimethylpropanimidamide (CID 525900) is N'-decyl-N,N,2-trimethylpropanimidamide.
What is the SMILES notation for N'-decyl-N,N,2-trimethylpropanimidamide?
The canonical SMILES for N'-decyl-N,N,2-trimethylpropanimidamide is CCCCCCCCCC/N=C(\C(C)C)N(C)C.
What is the InChIKey of N'-decyl-N,N,2-trimethylpropanimidamide?
The InChIKey is DLOAVHDDXIBZTA-WUKNDPDISA-N. The full InChI is InChI=1S/C16H34N2/c1-6-7-8-9-10-11-12-13-14-17-16(15(2)3)18(4)5/h15H,6-14H2,1-5H3/b17-16+.
What are the key properties of N'-decyl-N,N,2-trimethylpropanimidamide?
N'-decyl-N,N,2-trimethylpropanimidamide has a molecular weight of 254.46 g/mol, XLogP of 4.74, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-decyl-N,N,2-trimethylpropanimidamide is sourced from PubChem (CID 525900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).