1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine

C12H17NOS — CID 53238284

IUPAC1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine
SMILESNC1(C2OCCc3sccc32)CCCC1
InChIInChI=1S/C12H17NOS/c13-12(5-1-2-6-12)11-9-4-8-15-10(9)3-7-14-11/h4,8,11H,1-3,5-7,13H2
InChIKeyMMPIDIHCZPIMKH-UHFFFAOYSA-N
MW223.34 g/mol
LogP2.63
Rot. Bonds1

About 1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine

1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine (PubChem CID 53238284) has the molecular formula C12H17NOS and a molecular weight of 223.34 g/mol. Its IUPAC name is 1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine
PubChem CID53238284
Molecular FormulaC12H17NOS
Molecular Weight223.34 g/mol
Exact Mass223.10
IUPAC Name1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine
SMILESNC1(C2OCCc3sccc32)CCCC1
InChIInChI=1S/C12H17NOS/c13-12(5-1-2-6-12)11-9-4-8-15-10(9)3-7-14-11/h4,8,11H,1-3,5-7,13H2
InChIKeyMMPIDIHCZPIMKH-UHFFFAOYSA-N
XLogP2.63
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.34
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine?
The IUPAC name of 1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine (CID 53238284) is 1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine.
What is the SMILES notation for 1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine?
The canonical SMILES for 1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine is NC1(C2OCCc3sccc32)CCCC1.
What is the InChIKey of 1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine?
The InChIKey is MMPIDIHCZPIMKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NOS/c13-12(5-1-2-6-12)11-9-4-8-15-10(9)3-7-14-11/h4,8,11H,1-3,5-7,13H2.
What are the key properties of 1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine?
1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine has a molecular weight of 223.34 g/mol, XLogP of 2.63, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6,7-dihydro-4H-thieno[3,2-c]pyran-4-yl)cyclopentan-1-amine is sourced from PubChem (CID 53238284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).