2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine

C10H16N2S — CID 16789654

IUPAC2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine
SMILESCC(CN)N1CCc2sccc2C1
InChIInChI=1S/C10H16N2S/c1-8(6-11)12-4-2-10-9(7-12)3-5-13-10/h3,5,8H,2,4,6-7,11H2,1H3
InChIKeyMQKOIUAPLLHABT-UHFFFAOYSA-N
MW196.32 g/mol
LogP1.45
Rot. Bonds2

About 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine

2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine (PubChem CID 16789654) has the molecular formula C10H16N2S and a molecular weight of 196.32 g/mol. Its IUPAC name is 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine.

Molecular Properties

Compound Name2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine
PubChem CID16789654
Molecular FormulaC10H16N2S
Molecular Weight196.32 g/mol
Exact Mass196.10
IUPAC Name2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine
SMILESCC(CN)N1CCc2sccc2C1
InChIInChI=1S/C10H16N2S/c1-8(6-11)12-4-2-10-9(7-12)3-5-13-10/h3,5,8H,2,4,6-7,11H2,1H3
InChIKeyMQKOIUAPLLHABT-UHFFFAOYSA-N
XLogP1.45
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine?
The IUPAC name of 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine (CID 16789654) is 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine.
What is the SMILES notation for 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine?
The canonical SMILES for 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine is CC(CN)N1CCc2sccc2C1.
What is the InChIKey of 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine?
The InChIKey is MQKOIUAPLLHABT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2S/c1-8(6-11)12-4-2-10-9(7-12)3-5-13-10/h3,5,8H,2,4,6-7,11H2,1H3.
What are the key properties of 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine?
2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine has a molecular weight of 196.32 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-amine is sourced from PubChem (CID 16789654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).