5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride

C14H20ClN3S — CID 75509584

IUPAC5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride
SMILESCCN(CCc1cccs1)Cc1ccc(N)nc1.Cl
InChIInChI=1S/C14H19N3S.ClH/c1-2-17(8-7-13-4-3-9-18-13)11-12-5-6-14(15)16-10-12;/h3-6,9-10H,2,7-8,11H2,1H3,(H2,15,16);1H
InChIKeyUBOHXEAGZQAKOQ-UHFFFAOYSA-N
MW297.86 g/mol
LogP3.21
Rot. Bonds6

About 5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride

5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride (PubChem CID 75509584) has the molecular formula C14H20ClN3S and a molecular weight of 297.86 g/mol. Its IUPAC name is 5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride.

Molecular Properties

Compound Name5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride
PubChem CID75509584
Molecular FormulaC14H20ClN3S
Molecular Weight297.86 g/mol
Exact Mass297.11
IUPAC Name5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride
SMILESCCN(CCc1cccs1)Cc1ccc(N)nc1.Cl
InChIInChI=1S/C14H19N3S.ClH/c1-2-17(8-7-13-4-3-9-18-13)11-12-5-6-14(15)16-10-12;/h3-6,9-10H,2,7-8,11H2,1H3,(H2,15,16);1H
InChIKeyUBOHXEAGZQAKOQ-UHFFFAOYSA-N
XLogP3.21
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.86
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride 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

5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120898756
4-[[ethyl(thiophen-2-ylmethyl)amino]methyl]aniline
CID 43458870
4-[2-[ethyl(thiophen-2-ylmethyl)amino]ethyl]-1,3-thiazol-2-amine
CID 65484257
5-N-methyl-5-N-(thiophen-2-ylmethyl)pyridine-2,5-diamine
CID 43527362
2-[ethyl(2-thiophen-2-ylethyl)amino]ethanethioamide
CID 63775676
4-[2-(diethylamino)ethyl]-N-(2-thiophen-2-ylethyl)aniline
CID 83963038
5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine
CID 79470640
N-ethyl-2-(4-methoxyphenyl)-N-(thiophen-2-ylmethyl)ethanamine
CID 78825986
2-bromo-5-[[ethyl(thiophen-2-ylmethyl)amino]methyl]aniline
CID 113335085
N',2-diethyl-N'-(thiophen-2-ylmethyl)butane-1,4-diamine
CID 81079435
2-[4-[2-[ethyl(thiophen-2-ylmethyl)amino]ethoxy]phenyl]ethanamine
CID 61439178
2-[4-(aminomethyl)phenoxy]-N-ethyl-N-(thiophen-2-ylmethyl)ethanamine
CID 61439221

Frequently Asked Questions

What is the IUPAC name of 5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride?
The IUPAC name of 5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride (CID 75509584) is 5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride.
What is the SMILES notation for 5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride?
The canonical SMILES for 5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride is CCN(CCc1cccs1)Cc1ccc(N)nc1.Cl.
What is the InChIKey of 5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride?
The InChIKey is UBOHXEAGZQAKOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3S.ClH/c1-2-17(8-7-13-4-3-9-18-13)11-12-5-6-14(15)16-10-12;/h3-6,9-10H,2,7-8,11H2,1H3,(H2,15,16);1H.
What are the key properties of 5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride?
5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride has a molecular weight of 297.86 g/mol, XLogP of 3.21, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[ethyl(2-thiophen-2-ylethyl)amino]methyl]pyridin-2-amine;hydrochloride is sourced from PubChem (CID 75509584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).