(4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine

C8H10F2N2S — CID 171786885

IUPAC(4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine
SMILESNCC1NCC(F)(F)c2ccsc21
InChIInChI=1S/C8H10F2N2S/c9-8(10)4-12-6(3-11)7-5(8)1-2-13-7/h1-2,6,12H,3-4,11H2
InChIKeySBEYFIZBCDJZGE-UHFFFAOYSA-N
MW204.24 g/mol
LogP1.44
Rot. Bonds1

About (4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine

(4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine (PubChem CID 171786885) has the molecular formula C8H10F2N2S and a molecular weight of 204.24 g/mol. Its IUPAC name is (4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine.

Molecular Properties

Compound Name(4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine
PubChem CID171786885
Molecular FormulaC8H10F2N2S
Molecular Weight204.24 g/mol
Exact Mass204.05
IUPAC Name(4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine
SMILESNCC1NCC(F)(F)c2ccsc21
InChIInChI=1S/C8H10F2N2S/c9-8(10)4-12-6(3-11)7-5(8)1-2-13-7/h1-2,6,12H,3-4,11H2
InChIKeySBEYFIZBCDJZGE-UHFFFAOYSA-N
XLogP1.44
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.24
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine?
The IUPAC name of (4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine (CID 171786885) is (4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine.
What is the SMILES notation for (4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine?
The canonical SMILES for (4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine is NCC1NCC(F)(F)c2ccsc21.
What is the InChIKey of (4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine?
The InChIKey is SBEYFIZBCDJZGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2S/c9-8(10)4-12-6(3-11)7-5(8)1-2-13-7/h1-2,6,12H,3-4,11H2.
What are the key properties of (4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine?
(4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine has a molecular weight of 204.24 g/mol, XLogP of 1.44, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4,4-difluoro-6,7-dihydro-5H-thieno[2,3-c]pyridin-7-yl)methanamine is sourced from PubChem (CID 171786885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).