N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline

C24H28N2 — CID 22900107

IUPACN-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline
SMILESCc1ccc(N(c2ccc(CCN)cc2)c2ccc(C)c(C)c2)cc1C
InChIInChI=1S/C24H28N2/c1-17-5-9-23(15-19(17)3)26(24-10-6-18(2)20(4)16-24)22-11-7-21(8-12-22)13-14-25/h5-12,15-16H,13-14,25H2,1-4H3
InChIKeyBQUYSBJFASSGKM-UHFFFAOYSA-N
MW344.50 g/mol
LogP5.89
Rot. Bonds5

About N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline

N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline (PubChem CID 22900107) has the molecular formula C24H28N2 and a molecular weight of 344.50 g/mol. Its IUPAC name is N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline.

Molecular Properties

Compound NameN-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline
PubChem CID22900107
Molecular FormulaC24H28N2
Molecular Weight344.50 g/mol
Exact Mass344.23
IUPAC NameN-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline
SMILESCc1ccc(N(c2ccc(CCN)cc2)c2ccc(C)c(C)c2)cc1C
InChIInChI=1S/C24H28N2/c1-17-5-9-23(15-19(17)3)26(24-10-6-18(2)20(4)16-24)22-11-7-21(8-12-22)13-14-25/h5-12,15-16H,13-14,25H2,1-4H3
InChIKeyBQUYSBJFASSGKM-UHFFFAOYSA-N
XLogP5.89
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.50
LogP ≤ 55.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline 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-(N-(3,4-dimethylphenyl)-3,4-dimethylanilino)phenyl]methanol
CID 54528653
N-(3,4-dimethylphenyl)-3,4-dimethyl-N-(4-methylphenyl)aniline;ethane
CID 143481987
N-[4-[4-[N-(3,4-dimethylphenyl)-4-(2-methoxyethyl)anilino]phenyl]phenyl]-3,4-dimethyl-N-(4-propylphenyl)aniline
CID 59649188
4-[N-(3,4-dimethylphenyl)-4-[2-[4-(N-(3,4-dimethylphenyl)-4-methoxyanilino)phenyl]ethyl]anilino]benzaldehyde
CID 89418016
N-[4-[2-[4-[N-(3,4-dimethylphenyl)-4-(3-phenylmethoxypropyl)anilino]phenyl]ethyl]phenyl]-3,4-dimethyl-N-[4-(3-phenylmethoxypropyl)phenyl]aniline
CID 71277351
N,N-bis(4-tert-butylphenyl)-3,4-dimethylaniline
CID 22630576
4-[4-[4-(4-but-2-enoyloxybutyl)-N-(3,4-dimethylphenyl)anilino]phenyl]butyl but-2-enoate
CID 123385636
3-[4-[N-(3,4-dimethylphenyl)-4-[3-[(E)-pent-2-enoyl]oxypropyl]anilino]phenyl]propyl (E)-pent-2-enoate
CID 90168252
2-[4-[(3,4-dimethylphenoxy)methyl]phenyl]ethanamine
CID 105350576
[4-[N-(3,4-dimethylphenyl)-4-(2-methylprop-2-enoyloxymethyl)anilino]phenyl]methyl 2-methylprop-2-enoate
CID 59392120
N-[4-[4-[4-(N-(3,4-dimethylphenyl)anilino)phenyl]phenyl]phenyl]-3,4-dimethyl-N-phenylaniline
CID 137434908
1-N,4-N-bis(3,4-dimethylphenyl)-1-N,4-N-bis(4-phenylphenyl)benzene-1,4-diamine
CID 59470459

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline?
The IUPAC name of N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline (CID 22900107) is N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline.
What is the SMILES notation for N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline?
The canonical SMILES for N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline is Cc1ccc(N(c2ccc(CCN)cc2)c2ccc(C)c(C)c2)cc1C.
What is the InChIKey of N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline?
The InChIKey is BQUYSBJFASSGKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2/c1-17-5-9-23(15-19(17)3)26(24-10-6-18(2)20(4)16-24)22-11-7-21(8-12-22)13-14-25/h5-12,15-16H,13-14,25H2,1-4H3.
What are the key properties of N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline?
N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline has a molecular weight of 344.50 g/mol, XLogP of 5.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-aminoethyl)phenyl]-N-(3,4-dimethylphenyl)-3,4-dimethylaniline is sourced from PubChem (CID 22900107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).