N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline

C22H24N2 — CID 23656601

IUPACN-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline
SMILESc1ccc(NCCc2ccc(CCNc3ccccc3)cc2)cc1
InChIInChI=1S/C22H24N2/c1-3-7-21(8-4-1)23-17-15-19-11-13-20(14-12-19)16-18-24-22-9-5-2-6-10-22/h1-14,23-24H,15-18H2
InChIKeyKYUOJDGFIHKBIW-UHFFFAOYSA-N
MW316.45 g/mol
LogP5.00
Rot. Bonds8

About N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline

N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline (PubChem CID 23656601) has the molecular formula C22H24N2 and a molecular weight of 316.45 g/mol. Its IUPAC name is N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline.

Molecular Properties

Compound NameN-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline
PubChem CID23656601
Molecular FormulaC22H24N2
Molecular Weight316.45 g/mol
Exact Mass316.19
IUPAC NameN-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline
SMILESc1ccc(NCCc2ccc(CCNc3ccccc3)cc2)cc1
InChIInChI=1S/C22H24N2/c1-3-7-21(8-4-1)23-17-15-19-11-13-20(14-12-19)16-18-24-22-9-5-2-6-10-22/h1-14,23-24H,15-18H2
InChIKeyKYUOJDGFIHKBIW-UHFFFAOYSA-N
XLogP5.00
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.45
LogP ≤ 55.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline 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

Desipramine
CID 2995
Desipramine Hydrochloride
CID 65327
Leucomalachite green
CID 67215
Leucocrystal Violet
CID 69048
4,4'-Dioctyldiphenylamine
CID 7569
N,N'-Di-o-tolylethylenediamine
CID 66759
Benzylaniline
CID 66028
4,4'-Methylenebis(N-methylaniline)
CID 15735
N-Phenyl-1-(phenylmethyl)-4-piperidinamine
CID 70865
Didesmethylimipramine
CID 159642
N-(3-Methylphenyl)benzenemethanamine
CID 222281
Metapramine
CID 65700

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline?
The IUPAC name of N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline (CID 23656601) is N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline.
What is the SMILES notation for N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline?
The canonical SMILES for N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline is c1ccc(NCCc2ccc(CCNc3ccccc3)cc2)cc1.
What is the InChIKey of N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline?
The InChIKey is KYUOJDGFIHKBIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2/c1-3-7-21(8-4-1)23-17-15-19-11-13-20(14-12-19)16-18-24-22-9-5-2-6-10-22/h1-14,23-24H,15-18H2.
What are the key properties of N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline?
N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline has a molecular weight of 316.45 g/mol, XLogP of 5.00, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(2-anilinoethyl)phenyl]ethyl]aniline is sourced from PubChem (CID 23656601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).