2-(aminomethyl)-N-ethyl-N-phenylaniline

C15H18N2 — CID 28600877

IUPAC2-(aminomethyl)-N-ethyl-N-phenylaniline
SMILESCCN(c1ccccc1)c1ccccc1CN
InChIInChI=1S/C15H18N2/c1-2-17(14-9-4-3-5-10-14)15-11-7-6-8-13(15)12-16/h3-11H,2,12,16H2,1H3
InChIKeyFXCJIHNQPFWFLI-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.30
Rot. Bonds4

About 2-(aminomethyl)-N-ethyl-N-phenylaniline

2-(aminomethyl)-N-ethyl-N-phenylaniline (PubChem CID 28600877) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-(aminomethyl)-N-ethyl-N-phenylaniline.

Molecular Properties

Compound Name2-(aminomethyl)-N-ethyl-N-phenylaniline
PubChem CID28600877
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name2-(aminomethyl)-N-ethyl-N-phenylaniline
SMILESCCN(c1ccccc1)c1ccccc1CN
InChIInChI=1S/C15H18N2/c1-2-17(14-9-4-3-5-10-14)15-11-7-6-8-13(15)12-16/h3-11H,2,12,16H2,1H3
InChIKeyFXCJIHNQPFWFLI-UHFFFAOYSA-N
XLogP3.30
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(aminomethyl)-N-ethyl-N-(2-fluorophenyl)aniline
CID 55125489
2-(2-aminoethyl)-4-chloro-N-ethyl-N-phenylaniline
CID 114860392
N-ethyl-N-phenylnaphthalen-1-amine;methane
CID 143268632
4-(aminomethyl)-2-chloro-N-ethyl-N-phenylaniline
CID 78924406
2-(2-aminopropyl)-N-ethyl-N-(4-methylphenyl)aniline
CID 63816327
3-chloro-1-N-ethyl-1-N-phenylbenzene-1,2-diamine
CID 113458493
2-ethoxy-N-ethyl-N-phenylaniline
CID 101288968
3-(N-ethylanilino)-2-methylphenol
CID 68824539
2-(bromomethyl)-N-ethyl-4-fluoro-N-phenylaniline
CID 107079476
3-(aminomethyl)-N-ethyl-5-fluoro-N-phenylpyridin-2-amine
CID 114035183
2-(bromomethyl)-N-ethyl-N-(3-methylphenyl)aniline
CID 107080798
2-(aminomethyl)-N-ethyl-3-fluoro-N-(4-fluorophenyl)aniline
CID 79515822

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-ethyl-N-phenylaniline?
The IUPAC name of 2-(aminomethyl)-N-ethyl-N-phenylaniline (CID 28600877) is 2-(aminomethyl)-N-ethyl-N-phenylaniline.
What is the SMILES notation for 2-(aminomethyl)-N-ethyl-N-phenylaniline?
The canonical SMILES for 2-(aminomethyl)-N-ethyl-N-phenylaniline is CCN(c1ccccc1)c1ccccc1CN.
What is the InChIKey of 2-(aminomethyl)-N-ethyl-N-phenylaniline?
The InChIKey is FXCJIHNQPFWFLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-2-17(14-9-4-3-5-10-14)15-11-7-6-8-13(15)12-16/h3-11H,2,12,16H2,1H3.
What are the key properties of 2-(aminomethyl)-N-ethyl-N-phenylaniline?
2-(aminomethyl)-N-ethyl-N-phenylaniline has a molecular weight of 226.32 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-ethyl-N-phenylaniline is sourced from PubChem (CID 28600877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).