2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline

C19H24N2 — CID 143925880

IUPAC2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline
SMILESC=Cc1cc(Cc2ccccc2CCNC)ccc1NC
InChIInChI=1S/C19H24N2/c1-4-16-13-15(9-10-19(16)21-3)14-18-8-6-5-7-17(18)11-12-20-2/h4-10,13,20-21H,1,11-12,14H2,2-3H3
InChIKeyUVLKJAKNOMZVAN-UHFFFAOYSA-N
MW280.42 g/mol
LogP3.72
Rot. Bonds7

About 2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline

2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline (PubChem CID 143925880) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is 2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline.

Molecular Properties

Compound Name2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline
PubChem CID143925880
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC Name2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline
SMILESC=Cc1cc(Cc2ccccc2CCNC)ccc1NC
InChIInChI=1S/C19H24N2/c1-4-16-13-15(9-10-19(16)21-3)14-18-8-6-5-7-17(18)11-12-20-2/h4-10,13,20-21H,1,11-12,14H2,2-3H3
InChIKeyUVLKJAKNOMZVAN-UHFFFAOYSA-N
XLogP3.72
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-ethenyl-3-methoxyphenyl)-N-methylethanamine
CID 144546494
2-ethenyl-1-N,4-N-dimethylbenzene-1,4-diamine
CID 169168599
2-[2-(aminomethyl)phenyl]-N-methylethanamine
CID 58788115
[3-ethenyl-4-(methylamino)phenyl]boronic acid
CID 143196109
2-(2-bromophenyl)-N-methylethanamine
CID 11964124
2-[[4-(methylamino)-3-propan-2-ylphenyl]methyl]phenol
CID 132570116
N-methyl-2-(2-methylphenyl)ethanamine;toluene
CID 142152670
4-[(2-ethenylphenyl)methyl]-N,N-dimethylaniline
CID 130274462
N-methyl-2-[2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]phenyl]ethanamine
CID 115463972
1-chloro-4-[(2-ethenylphenyl)methyl]benzene
CID 21218414
2-ethenyl-N-(2-methylphenyl)-4-[(4-piperazin-1-ylphenyl)methyl]aniline
CID 139444795
4-[(2-fluorophenyl)methyl]-N-methyl-2-(3-methylbutan-2-yl)aniline
CID 142307020

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline?
The IUPAC name of 2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline (CID 143925880) is 2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline.
What is the SMILES notation for 2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline?
The canonical SMILES for 2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline is C=Cc1cc(Cc2ccccc2CCNC)ccc1NC.
What is the InChIKey of 2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline?
The InChIKey is UVLKJAKNOMZVAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-4-16-13-15(9-10-19(16)21-3)14-18-8-6-5-7-17(18)11-12-20-2/h4-10,13,20-21H,1,11-12,14H2,2-3H3.
What are the key properties of 2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline?
2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline has a molecular weight of 280.42 g/mol, XLogP of 3.72, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-N-methyl-4-[[2-[2-(methylamino)ethyl]phenyl]methyl]aniline is sourced from PubChem (CID 143925880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).