2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol

C10H16N2OS — CID 53379991

IUPAC2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol
SMILESCN(CCO)c1cc2c(s1)CCNC2
InChIInChI=1S/C10H16N2OS/c1-12(4-5-13)10-6-8-7-11-3-2-9(8)14-10/h6,11,13H,2-5,7H2,1H3
InChIKeyGGFDPDOBIUTUMG-UHFFFAOYSA-N
MW212.32 g/mol
LogP0.82
Rot. Bonds3

About 2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol

2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol (PubChem CID 53379991) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol.

Molecular Properties

Compound Name2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol
PubChem CID53379991
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol
SMILESCN(CCO)c1cc2c(s1)CCNC2
InChIInChI=1S/C10H16N2OS/c1-12(4-5-13)10-6-8-7-11-3-2-9(8)14-10/h6,11,13H,2-5,7H2,1H3
InChIKeyGGFDPDOBIUTUMG-UHFFFAOYSA-N
XLogP0.82
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol?
The IUPAC name of 2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol (CID 53379991) is 2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol.
What is the SMILES notation for 2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol?
The canonical SMILES for 2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol is CN(CCO)c1cc2c(s1)CCNC2.
What is the InChIKey of 2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol?
The InChIKey is GGFDPDOBIUTUMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-12(4-5-13)10-6-8-7-11-3-2-9(8)14-10/h6,11,13H,2-5,7H2,1H3.
What are the key properties of 2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol?
2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol has a molecular weight of 212.32 g/mol, XLogP of 0.82, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)amino]ethanol is sourced from PubChem (CID 53379991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).