N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine

C16H27N — CID 43484222

IUPACN,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine
SMILESCNC(CCC(C)C)c1c(C)cc(C)cc1C
InChIInChI=1S/C16H27N/c1-11(2)7-8-15(17-6)16-13(4)9-12(3)10-14(16)5/h9-11,15,17H,7-8H2,1-6H3
InChIKeyHDQOVHQESUURHN-UHFFFAOYSA-N
MW233.40 g/mol
LogP4.31
Rot. Bonds5

About N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine

N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine (PubChem CID 43484222) has the molecular formula C16H27N and a molecular weight of 233.40 g/mol. Its IUPAC name is N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine.

Molecular Properties

Compound NameN,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine
PubChem CID43484222
Molecular FormulaC16H27N
Molecular Weight233.40 g/mol
Exact Mass233.21
IUPAC NameN,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine
SMILESCNC(CCC(C)C)c1c(C)cc(C)cc1C
InChIInChI=1S/C16H27N/c1-11(2)7-8-15(17-6)16-13(4)9-12(3)10-14(16)5/h9-11,15,17H,7-8H2,1-6H3
InChIKeyHDQOVHQESUURHN-UHFFFAOYSA-N
XLogP4.31
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.40
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine 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

[4-methyl-1-(2,4,6-trimethylphenyl)pentyl]hydrazine
CID 105294214
N-methyl-2-(2-methylpropylsulfanyl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 64610898
N-methyl-2-(3-methylbutylsulfonyl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 107760379
N'-ethyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine
CID 63467905
N'-cyclopropyl-N-methyl-N'-(2-methylpropyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine
CID 63467799
N-methyl-2-(2-methylpropylsulfinyl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 64652449
N-methyl-1-(2,4,6-trimethylphenyl)hex-5-yn-1-amine
CID 105033708
N-methyl-2-(2-methylbutylsulfanyl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 107763634
3-cyclohexyl-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine
CID 43484245
N'-(3,3-dimethylbutan-2-yl)-N,N'-dimethyl-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine
CID 63469264
3-(2,2-difluoroethoxy)-N-methyl-1-(2,4,6-trimethylphenyl)propan-1-amine
CID 103207219
N-methyl-2-methylsulfonyl-1-(2,4,6-trimethylphenyl)ethanamine
CID 62786079

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine?
The IUPAC name of N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine (CID 43484222) is N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine.
What is the SMILES notation for N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine?
The canonical SMILES for N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine is CNC(CCC(C)C)c1c(C)cc(C)cc1C.
What is the InChIKey of N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine?
The InChIKey is HDQOVHQESUURHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N/c1-11(2)7-8-15(17-6)16-13(4)9-12(3)10-14(16)5/h9-11,15,17H,7-8H2,1-6H3.
What are the key properties of N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine?
N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine has a molecular weight of 233.40 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-1-(2,4,6-trimethylphenyl)pentan-1-amine is sourced from PubChem (CID 43484222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).