2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine

C14H18N2S2 — CID 55011117

IUPAC2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine
SMILESCC1c2ccsc2CCN1C(CN)c1ccsc1
InChIInChI=1S/C14H18N2S2/c1-10-12-4-7-18-14(12)2-5-16(10)13(8-15)11-3-6-17-9-11/h3-4,6-7,9-10,13H,2,5,8,15H2,1H3
InChIKeyGPOLOUCOVDQQNS-UHFFFAOYSA-N
MW278.45 g/mol
LogP3.43
Rot. Bonds3

About 2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine

2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine (PubChem CID 55011117) has the molecular formula C14H18N2S2 and a molecular weight of 278.45 g/mol. Its IUPAC name is 2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine.

Molecular Properties

Compound Name2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine
PubChem CID55011117
Molecular FormulaC14H18N2S2
Molecular Weight278.45 g/mol
Exact Mass278.09
IUPAC Name2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine
SMILESCC1c2ccsc2CCN1C(CN)c1ccsc1
InChIInChI=1S/C14H18N2S2/c1-10-12-4-7-18-14(12)2-5-16(10)13(8-15)11-3-6-17-9-11/h3-4,6-7,9-10,13H,2,5,8,15H2,1H3
InChIKeyGPOLOUCOVDQQNS-UHFFFAOYSA-N
XLogP3.43
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.45
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine?
The IUPAC name of 2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine (CID 55011117) is 2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine.
What is the SMILES notation for 2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine?
The canonical SMILES for 2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine is CC1c2ccsc2CCN1C(CN)c1ccsc1.
What is the InChIKey of 2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine?
The InChIKey is GPOLOUCOVDQQNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2S2/c1-10-12-4-7-18-14(12)2-5-16(10)13(8-15)11-3-6-17-9-11/h3-4,6-7,9-10,13H,2,5,8,15H2,1H3.
What are the key properties of 2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine?
2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine has a molecular weight of 278.45 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine is sourced from PubChem (CID 55011117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).