(7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine

C9H13NOS — CID 155682851

IUPAC(7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine
SMILESCN(C)[C@H]1OCCc2ccsc21
InChIInChI=1S/C9H13NOS/c1-10(2)9-8-7(3-5-11-9)4-6-12-8/h4,6,9H,3,5H2,1-2H3/t9-/m0/s1
InChIKeyVEYRLVWKCAOBSU-VIFPVBQESA-N
MW183.28 g/mol
LogP1.88
Rot. Bonds1

About (7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine

(7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine (PubChem CID 155682851) has the molecular formula C9H13NOS and a molecular weight of 183.28 g/mol. Its IUPAC name is (7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine.

Molecular Properties

Compound Name(7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine
PubChem CID155682851
Molecular FormulaC9H13NOS
Molecular Weight183.28 g/mol
Exact Mass183.07
IUPAC Name(7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine
SMILESCN(C)[C@H]1OCCc2ccsc21
InChIInChI=1S/C9H13NOS/c1-10(2)9-8-7(3-5-11-9)4-6-12-8/h4,6,9H,3,5H2,1-2H3/t9-/m0/s1
InChIKeyVEYRLVWKCAOBSU-VIFPVBQESA-N
XLogP1.88
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.28
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine?
The IUPAC name of (7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine (CID 155682851) is (7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine.
What is the SMILES notation for (7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine?
The canonical SMILES for (7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine is CN(C)[C@H]1OCCc2ccsc21.
What is the InChIKey of (7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine?
The InChIKey is VEYRLVWKCAOBSU-VIFPVBQESA-N. The full InChI is InChI=1S/C9H13NOS/c1-10(2)9-8-7(3-5-11-9)4-6-12-8/h4,6,9H,3,5H2,1-2H3/t9-/m0/s1.
What are the key properties of (7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine?
(7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine has a molecular weight of 183.28 g/mol, XLogP of 1.88, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7S)-N,N-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyran-7-amine is sourced from PubChem (CID 155682851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).