7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine

C14H21NS — CID 165470573

IUPAC7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine
SMILESCC1(C2CCCCC2)NCCc2ccsc21
InChIInChI=1S/C14H21NS/c1-14(12-5-3-2-4-6-12)13-11(7-9-15-14)8-10-16-13/h8,10,12,15H,2-7,9H2,1H3
InChIKeyAEBLFBMLJDWEPJ-UHFFFAOYSA-N
MW235.40 g/mol
LogP3.69
Rot. Bonds1

About 7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine

7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine (PubChem CID 165470573) has the molecular formula C14H21NS and a molecular weight of 235.40 g/mol. Its IUPAC name is 7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine.

Molecular Properties

Compound Name7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine
PubChem CID165470573
Molecular FormulaC14H21NS
Molecular Weight235.40 g/mol
Exact Mass235.14
IUPAC Name7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine
SMILESCC1(C2CCCCC2)NCCc2ccsc21
InChIInChI=1S/C14H21NS/c1-14(12-5-3-2-4-6-12)13-11(7-9-15-14)8-10-16-13/h8,10,12,15H,2-7,9H2,1H3
InChIKeyAEBLFBMLJDWEPJ-UHFFFAOYSA-N
XLogP3.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.40
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine?
The IUPAC name of 7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine (CID 165470573) is 7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine.
What is the SMILES notation for 7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine?
The canonical SMILES for 7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine is CC1(C2CCCCC2)NCCc2ccsc21.
What is the InChIKey of 7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine?
The InChIKey is AEBLFBMLJDWEPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NS/c1-14(12-5-3-2-4-6-12)13-11(7-9-15-14)8-10-16-13/h8,10,12,15H,2-7,9H2,1H3.
What are the key properties of 7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine?
7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine has a molecular weight of 235.40 g/mol, XLogP of 3.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-c]pyridine is sourced from PubChem (CID 165470573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).