N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine

C15H20N2S — CID 107555749

IUPACN-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine
SMILESCCN(Cc1ccccc1)Cc1ccc(CN)s1
InChIInChI=1S/C15H20N2S/c1-2-17(11-13-6-4-3-5-7-13)12-15-9-8-14(10-16)18-15/h3-9H,2,10-12,16H2,1H3
InChIKeyYEEFELPITPSWIN-UHFFFAOYSA-N
MW260.41 g/mol
LogP3.23
Rot. Bonds6

About N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine

N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine (PubChem CID 107555749) has the molecular formula C15H20N2S and a molecular weight of 260.41 g/mol. Its IUPAC name is N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine.

Molecular Properties

Compound NameN-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine
PubChem CID107555749
Molecular FormulaC15H20N2S
Molecular Weight260.41 g/mol
Exact Mass260.13
IUPAC NameN-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine
SMILESCCN(Cc1ccccc1)Cc1ccc(CN)s1
InChIInChI=1S/C15H20N2S/c1-2-17(11-13-6-4-3-5-7-13)12-15-9-8-14(10-16)18-15/h3-9H,2,10-12,16H2,1H3
InChIKeyYEEFELPITPSWIN-UHFFFAOYSA-N
XLogP3.23
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.41
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine 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

N-benzyl-N-[(5-bromothiophen-2-yl)methyl]ethanamine
CID 54940208
N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-ethyl-2-methylprop-2-en-1-amine
CID 107555693
N-benzyl-N-ethylethanamine;ethene
CID 174895763
N-benzyl-N-ethylethanamine;methanethiol
CID 142975470
N-benzyl-N-[(5-hydrazinyl-1,3,4-thiadiazol-2-yl)methyl]ethanamine
CID 80613982
N-[[5-(aminomethyl)thiophen-2-yl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine
CID 107557366
N-benzyl-N-[(4-tert-butylphenyl)methyl]ethanamine
CID 58802076
1-N-benzyl-1-N-ethyl-2,2,3-trimethylbutane-1,3-diamine
CID 65266664
ethyl 2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]acetate
CID 3821334
N,N-dibenzyl-1-phenylmethanamine;2-methylpropane-1,2-diamine
CID 174802109
N-[[5-[[ethyl(pyridin-4-ylmethyl)amino]methyl]thiophen-2-yl]methyl]ethanamine
CID 107556276
N'-benzyl-N'-ethyl-2-phenylpropane-1,3-diamine
CID 43532152

Frequently Asked Questions

What is the IUPAC name of N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine?
The IUPAC name of N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine (CID 107555749) is N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine.
What is the SMILES notation for N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine?
The canonical SMILES for N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine is CCN(Cc1ccccc1)Cc1ccc(CN)s1.
What is the InChIKey of N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine?
The InChIKey is YEEFELPITPSWIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2S/c1-2-17(11-13-6-4-3-5-7-13)12-15-9-8-14(10-16)18-15/h3-9H,2,10-12,16H2,1H3.
What are the key properties of N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine?
N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine has a molecular weight of 260.41 g/mol, XLogP of 3.23, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-benzylethanamine is sourced from PubChem (CID 107555749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).