3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine

C13H18N2S — CID 81143575

IUPAC3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine
SMILESCCC(C)CC(N)c1cnc2ccsc2c1
InChIInChI=1S/C13H18N2S/c1-3-9(2)6-11(14)10-7-13-12(15-8-10)4-5-16-13/h4-5,7-9,11H,3,6,14H2,1-2H3
InChIKeySMZYSQHRBKTPAT-UHFFFAOYSA-N
MW234.37 g/mol
LogP3.73
Rot. Bonds4

About 3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine

3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine (PubChem CID 81143575) has the molecular formula C13H18N2S and a molecular weight of 234.37 g/mol. Its IUPAC name is 3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine.

Molecular Properties

Compound Name3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine
PubChem CID81143575
Molecular FormulaC13H18N2S
Molecular Weight234.37 g/mol
Exact Mass234.12
IUPAC Name3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine
SMILESCCC(C)CC(N)c1cnc2ccsc2c1
InChIInChI=1S/C13H18N2S/c1-3-9(2)6-11(14)10-7-13-12(15-8-10)4-5-16-13/h4-5,7-9,11H,3,6,14H2,1-2H3
InChIKeySMZYSQHRBKTPAT-UHFFFAOYSA-N
XLogP3.73
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.37
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indole
CID 5329361
dimethyl(3-{3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indol-1-yl}propyl)amine
CID 5329367
3-(5-Thien-3-ylpyridin-3-yl)-1Hindole 3h
CID 5329368
(5-Pyrid-3-ylthien-2-YL)methylamine
CID 11206290
N-Methyl-(5-pyrid-3-ylthien-2-yl)methylamine
CID 11321674
2-(1H-indol-3-yl)-2-(thiophen-2-yl)ethan-1-amine
CID 3745859
N,N-dimethyl-2-(4H-thieno[3,2-b]pyrrol-6-yl)ethanamine
CID 10330266
(-)-(R)-N,N-dimethyl-2-(3-(1-(3-methylpyridin-2-yl)ethyl)benzo[b]thiophen-2-yl)ethanamine
CID 11500781
(+)-(S)-N,N-dimethyl-2-(3-(1-(pyridin-2-yl)ethyl)benzo[b]thiophen-2-yl)ethanamine
CID 11551351
Benzo[B]thiophene-2-ethanamine, N,N-dimethyl-3-[1-(2-pyridinyl)ethyl]-
CID 11580426
Benzo(b)thiophene-2-ethanamine, N,N-dimethyl-3-((1R)-1-(2-pyridinyl)ethyl)-
CID 11580427
rac-N,N-dimethyl-2-(3-(1-(6-methylpyridin-3-yl)ethyl)benzo[b]thiophen-2-yl)ethanamine
CID 11681378

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine?
The IUPAC name of 3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine (CID 81143575) is 3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine.
What is the SMILES notation for 3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine?
The canonical SMILES for 3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine is CCC(C)CC(N)c1cnc2ccsc2c1.
What is the InChIKey of 3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine?
The InChIKey is SMZYSQHRBKTPAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2S/c1-3-9(2)6-11(14)10-7-13-12(15-8-10)4-5-16-13/h4-5,7-9,11H,3,6,14H2,1-2H3.
What are the key properties of 3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine?
3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine has a molecular weight of 234.37 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-thieno[3,2-b]pyridin-6-ylpentan-1-amine is sourced from PubChem (CID 81143575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).