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'}

Analyze N'-decyl-N,N,2-trimethylpropanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Pyrimidine, 1-butyl-1,4,5,6-tetrahydro-2-undecyl-
CID 220523
n'-Dodecyl-n,n-dimethylacetamidine
CID 51354956
N'-octadecyl-N,N-diethylacetamidine
CID 134163448
N'-hexadecyl-N,N-diethylacetamidine
CID 134163471
N,N-Dimethyl-N'-decyl-propionamidine
CID 525839
N,N-Dimethyl-N'-hexyl-propionamidine
CID 525841
N,N-Dimethyl-N'-nonyl-propionamidine
CID 525842
N,N-Dimethyl-N'-octyl-propionamidine
CID 525843
n-Dodecyl-n-methyl-3,4,5,6-tetrahydro-2h-azepin-7-amine
CID 186120
N,N-Dimethyl-N'-heptyl-propionamidine
CID 525840
N,N-Dimethyl-N'-decyl-pivalamidine
CID 525901
N,N-Dimethyl-N'-heptyl-isobutyramidine
CID 525902

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).