2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine

C14H23N — CID 54852975

IUPAC2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine
SMILESCCC(C)(C)NCCc1ccccc1C
InChIInChI=1S/C14H23N/c1-5-14(3,4)15-11-10-13-9-7-6-8-12(13)2/h6-9,15H,5,10-11H2,1-4H3
InChIKeyDHPNJJJZISLLHX-UHFFFAOYSA-N
MW205.34 g/mol
LogP3.32
Rot. Bonds5

About 2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine

2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine (PubChem CID 54852975) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is 2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine
PubChem CID54852975
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine
SMILESCCC(C)(C)NCCc1ccccc1C
InChIInChI=1S/C14H23N/c1-5-14(3,4)15-11-10-13-9-7-6-8-12(13)2/h6-9,15H,5,10-11H2,1-4H3
InChIKeyDHPNJJJZISLLHX-UHFFFAOYSA-N
XLogP3.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-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

2-methyl-N-[2-(2-methylphenyl)sulfanylethyl]butan-2-amine
CID 62576594
N-[2-(2-methylphenyl)ethyl]heptan-4-amine
CID 79762422
1-methyl-2-pentylbenzene
CID 524553
3-amino-2,2-dimethyl-N-[2-(2-methylphenyl)ethyl]propanamide
CID 79763048
N-[2-(2-methylphenyl)ethyl]-4,5-dihydro-1H-imidazol-2-amine
CID 115601227
1-(2,2-dimethylpropyl)-2-methylbenzene
CID 21464495
2-N-[2-(2,4-dimethylphenyl)ethyl]-1-N,2-dimethylpropane-1,2-diamine
CID 115132904
N-methyl-2-(2-methylphenyl)ethanamine;toluene
CID 142152670
4-N-[2-(2-methylphenyl)ethyl]benzene-1,4-diamine
CID 79763749
2-chloro-N-[2-(2-methylphenyl)ethyl]aniline
CID 54796032
1-[2-(2-methylphenyl)ethyl]-3-(2,4,4-trimethylpentan-2-yl)urea
CID 108899727
2-(2-methylphenyl)ethylazanium chloride
CID 21115517

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine?
The IUPAC name of 2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine (CID 54852975) is 2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine.
What is the SMILES notation for 2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine?
The canonical SMILES for 2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine is CCC(C)(C)NCCc1ccccc1C.
What is the InChIKey of 2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine?
The InChIKey is DHPNJJJZISLLHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-5-14(3,4)15-11-10-13-9-7-6-8-12(13)2/h6-9,15H,5,10-11H2,1-4H3.
What are the key properties of 2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine?
2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine has a molecular weight of 205.34 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(2-methylphenyl)ethyl]butan-2-amine is sourced from PubChem (CID 54852975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).