N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline

C20H26N2 — CID 21400955

IUPACN-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline
SMILESCCNc1ccc(C(=C(C)C)c2ccc(NCC)cc2)cc1
InChIInChI=1S/C20H26N2/c1-5-21-18-11-7-16(8-12-18)20(15(3)4)17-9-13-19(14-10-17)22-6-2/h7-14,21-22H,5-6H2,1-4H3
InChIKeyPBKGRCCZSVXTNL-UHFFFAOYSA-N
MW294.44 g/mol
LogP5.39
Rot. Bonds6

About N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline

N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline (PubChem CID 21400955) has the molecular formula C20H26N2 and a molecular weight of 294.44 g/mol. Its IUPAC name is N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline.

Molecular Properties

Compound NameN-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline
PubChem CID21400955
Molecular FormulaC20H26N2
Molecular Weight294.44 g/mol
Exact Mass294.21
IUPAC NameN-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline
SMILESCCNc1ccc(C(=C(C)C)c2ccc(NCC)cc2)cc1
InChIInChI=1S/C20H26N2/c1-5-21-18-11-7-16(8-12-18)20(15(3)4)17-9-13-19(14-10-17)22-6-2/h7-14,21-22H,5-6H2,1-4H3
InChIKeyPBKGRCCZSVXTNL-UHFFFAOYSA-N
XLogP5.39
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.44
LogP ≤ 55.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]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

bis[4-(ethylamino)phenyl]methanone
CID 157337395
N-methyl-4-[2-methyl-1-[4-(methylamino)phenyl]prop-1-enyl]aniline
CID 21400968
1-[4-[[4-[[4-(ethylamino)phenyl]diazenyl]phenyl]diazenyl]phenyl]ethanone
CID 134216733
bis(4-(ethylamino)benzoic acid);propane-1,3-diol
CID 175444404
ethane;N-ethyl-4-(ethylamino)benzamide;molecular hydrogen
CID 155715091
N,4-diethylaniline
CID 6429431
1-N-ethyl-4-N-[4-[4-(ethylamino)anilino]butyl]benzene-1,4-diamine
CID 18622915
[4-(ethylamino)phenyl] acetate
CID 15120452
[4-(ethylamino)phenyl]carbamic acid
CID 122640243
4-(ethylamino)-N-(2,2,3,3-tetramethylcyclopropyl)benzamide
CID 79356898
N-ethyl-4-(prop-1-en-2-yloxymethyl)aniline
CID 153362594
N-[4-(ethylamino)phenyl]benzamide
CID 71038629

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline?
The IUPAC name of N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline (CID 21400955) is N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline.
What is the SMILES notation for N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline?
The canonical SMILES for N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline is CCNc1ccc(C(=C(C)C)c2ccc(NCC)cc2)cc1.
What is the InChIKey of N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline?
The InChIKey is PBKGRCCZSVXTNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2/c1-5-21-18-11-7-16(8-12-18)20(15(3)4)17-9-13-19(14-10-17)22-6-2/h7-14,21-22H,5-6H2,1-4H3.
What are the key properties of N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline?
N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline has a molecular weight of 294.44 g/mol, XLogP of 5.39, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[1-[4-(ethylamino)phenyl]-2-methylprop-1-enyl]aniline is sourced from PubChem (CID 21400955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).