N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine

C16H23N3S — CID 64831319

IUPACN-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine
SMILESCCN1CCCC1CNC(C)c1cnc2ccsc2c1
InChIInChI=1S/C16H23N3S/c1-3-19-7-4-5-14(19)11-17-12(2)13-9-16-15(18-10-13)6-8-20-16/h6,8-10,12,14,17H,3-5,7,11H2,1-2H3
InChIKeyRHZCEVPYGKVNAK-UHFFFAOYSA-N
MW289.45 g/mol
LogP3.43
Rot. Bonds5

About N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine

N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine (PubChem CID 64831319) has the molecular formula C16H23N3S and a molecular weight of 289.45 g/mol. Its IUPAC name is N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine.

Molecular Properties

Compound NameN-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine
PubChem CID64831319
Molecular FormulaC16H23N3S
Molecular Weight289.45 g/mol
Exact Mass289.16
IUPAC NameN-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine
SMILESCCN1CCCC1CNC(C)c1cnc2ccsc2c1
InChIInChI=1S/C16H23N3S/c1-3-19-7-4-5-14(19)11-17-12(2)13-9-16-15(18-10-13)6-8-20-16/h6,8-10,12,14,17H,3-5,7,11H2,1-2H3
InChIKeyRHZCEVPYGKVNAK-UHFFFAOYSA-N
XLogP3.43
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.45
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine 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

tert-butyl 2-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]pyrrolidine-1-carboxylate
CID 113261329
N-(2-bicyclo[2.2.1]heptanylmethyl)-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 64830997
N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 43100978
N-(1-thieno[3,2-b]pyridin-6-ylethyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 81298392
[1-[(1-thieno[3,2-b]pyridin-6-ylethylamino)methyl]cyclohexyl]methanol
CID 115892911
N-[(1-ethylpyrrolidin-2-yl)methyl]-1-(4-methyl-1,3-thiazol-5-yl)ethanamine
CID 43764830
N-[(1-ethylpyrrolidin-2-yl)methyl]-1-pyridin-2-ylethanamine
CID 43195854
1-(3-bromo-4-fluorophenyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]ethanamine
CID 43764811
N'-(1-thieno[3,2-b]pyridin-6-ylethyl)butane-1,4-diamine
CID 64830758
N-[cycloheptyl(thieno[3,2-b]pyridin-6-yl)methyl]ethanamine
CID 82931928
4-ethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)aniline
CID 64830727
N-[2-(2-methylpropoxy)ethyl]-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 115713730

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine?
The IUPAC name of N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine (CID 64831319) is N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine.
What is the SMILES notation for N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine?
The canonical SMILES for N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine is CCN1CCCC1CNC(C)c1cnc2ccsc2c1.
What is the InChIKey of N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine?
The InChIKey is RHZCEVPYGKVNAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3S/c1-3-19-7-4-5-14(19)11-17-12(2)13-9-16-15(18-10-13)6-8-20-16/h6,8-10,12,14,17H,3-5,7,11H2,1-2H3.
What are the key properties of N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine?
N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine has a molecular weight of 289.45 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpyrrolidin-2-yl)methyl]-1-thieno[3,2-b]pyridin-6-ylethanamine is sourced from PubChem (CID 64831319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).