N-(4-cyanophenyl)-N-methyldecanamide

C18H26N2O — CID 65449344

IUPACN-(4-cyanophenyl)-N-methyldecanamide
SMILESCCCCCCCCCC(=O)N(C)c1ccc(C#N)cc1
InChIInChI=1S/C18H26N2O/c1-3-4-5-6-7-8-9-10-18(21)20(2)17-13-11-16(15-19)12-14-17/h11-14H,3-10H2,1-2H3
InChIKeyYJQFGPHOLHQGFA-UHFFFAOYSA-N
MW286.42 g/mol
LogP4.66
Rot. Bonds9

About N-(4-cyanophenyl)-N-methyldecanamide

N-(4-cyanophenyl)-N-methyldecanamide (PubChem CID 65449344) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-(4-cyanophenyl)-N-methyldecanamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-N-methyldecanamide
PubChem CID65449344
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-(4-cyanophenyl)-N-methyldecanamide
SMILESCCCCCCCCCC(=O)N(C)c1ccc(C#N)cc1
InChIInChI=1S/C18H26N2O/c1-3-4-5-6-7-8-9-10-18(21)20(2)17-13-11-16(15-19)12-14-17/h11-14H,3-10H2,1-2H3
InChIKeyYJQFGPHOLHQGFA-UHFFFAOYSA-N
XLogP4.66
TPSA44.10 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(4-cyanophenyl)-N-methyldecanamide 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

N-methyl-N-phenylnonanamide
CID 54136731
N-methyl-N-(4-nitrophenyl)octanamide
CID 71368131
N-(4-cyanophenyl)-N,3-dimethylpentanamide
CID 114874745
2-bromo-N-(4-cyanophenyl)-N-methylacetamide
CID 63679745
N-(4-carbamothioylphenyl)-N-methyloctanamide
CID 62971888
1-(4-cyanophenyl)-3,3-diethyl-1-methylurea
CID 79161464
N-(4-cyanophenyl)-N-methyl-3-piperidin-4-ylpropanamide
CID 62982663
6-amino-N-(3-cyanophenyl)-N-methylhexanamide
CID 62983019
4-[methyl(pentyl)amino]benzonitrile
CID 43295094
3-butyl-1-(4-cyanophenyl)-1-methylthiourea
CID 116508407
2-[2-(4-cyano-N-methylanilino)-2-oxoethoxy]acetic acid
CID 62983344
N-(3-hydroxyphenyl)-N-methylnonanamide
CID 107736082

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-N-methyldecanamide?
The IUPAC name of N-(4-cyanophenyl)-N-methyldecanamide (CID 65449344) is N-(4-cyanophenyl)-N-methyldecanamide.
What is the SMILES notation for N-(4-cyanophenyl)-N-methyldecanamide?
The canonical SMILES for N-(4-cyanophenyl)-N-methyldecanamide is CCCCCCCCCC(=O)N(C)c1ccc(C#N)cc1.
What is the InChIKey of N-(4-cyanophenyl)-N-methyldecanamide?
The InChIKey is YJQFGPHOLHQGFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-3-4-5-6-7-8-9-10-18(21)20(2)17-13-11-16(15-19)12-14-17/h11-14H,3-10H2,1-2H3.
What are the key properties of N-(4-cyanophenyl)-N-methyldecanamide?
N-(4-cyanophenyl)-N-methyldecanamide has a molecular weight of 286.42 g/mol, XLogP of 4.66, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-N-methyldecanamide is sourced from PubChem (CID 65449344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).