6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]

C20H25NO2S — CID 25129866

IUPAC6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]
SMILESCOC1Cc2sccc2C2(CCN(CCc3ccccc3)CC2)O1
InChIInChI=1S/C20H25NO2S/c1-22-19-15-18-17(8-14-24-18)20(23-19)9-12-21(13-10-20)11-7-16-5-3-2-4-6-16/h2-6,8,14,19H,7,9-13,15H2,1H3
InChIKeyIKFVGGXSMFNQKW-UHFFFAOYSA-N
MW343.49 g/mol
LogP3.83
Rot. Bonds4

About 6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]

6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine] (PubChem CID 25129866) has the molecular formula C20H25NO2S and a molecular weight of 343.49 g/mol. Its IUPAC name is 6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine].

Molecular Properties

Compound Name6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]
PubChem CID25129866
Molecular FormulaC20H25NO2S
Molecular Weight343.49 g/mol
Exact Mass343.16
IUPAC Name6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]
SMILESCOC1Cc2sccc2C2(CCN(CCc3ccccc3)CC2)O1
InChIInChI=1S/C20H25NO2S/c1-22-19-15-18-17(8-14-24-18)20(23-19)9-12-21(13-10-20)11-7-16-5-3-2-4-6-16/h2-6,8,14,19H,7,9-13,15H2,1H3
InChIKeyIKFVGGXSMFNQKW-UHFFFAOYSA-N
XLogP3.83
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.49
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine] with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Benzyl-6-methoxy-6,7-dihydrospiro[piperidine-4,4-thieno[3.2-c]pyran]
CID 25129510
6-Methoxy-1-(3-methylbutyl)-6,7-dihydrospiro[piperidine-4,4-thieno[3.2-c]pyran]
CID 25129512
1-(4-Fluorobenzyl)-6-methoxy-6,7-dihydrospiro[piperidine-4,4-thieno[3.2-c]pyran]
CID 25129862
6-Methoxy-1-(3-methylbut-2-enyl)-6,7-dihydrospiro[piperidine-4,4-thieno[3.2-c]pyran]
CID 25129863
1-(Cyclohexylmethyl)-6-methoxy-6,7-dihydrospiro[piperidine-4,4-thieno[3.2c]pyran]
CID 25129867
1'-Benzylspiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]
CID 25167087
1-(Cyclohexylmethyl)-6'',7''-dihydrospiro[piperidine-4,4''-thieno[3,2-c]pyran]
CID 25167287
(6R)-1'-benzyl-6-methoxyspiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]
CID 49798740
(6R)-1'-(cyclohexylmethyl)-6-methoxyspiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]
CID 49798743
(6R)-6-methoxy-1'-(3-methylbut-2-enyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]
CID 49798744
1'-Benzylspiro[6,7-dihydrothieno[3,4-c]pyran-4,4'-piperidine]
CID 56651522
1'-Benzyl-6-methoxyspiro[6,7-dihydrothieno[3,4-c]pyran-4,4'-piperidine]
CID 56651523

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]?
The IUPAC name of 6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine] (CID 25129866) is 6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine].
What is the SMILES notation for 6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]?
The canonical SMILES for 6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine] is COC1Cc2sccc2C2(CCN(CCc3ccccc3)CC2)O1.
What is the InChIKey of 6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]?
The InChIKey is IKFVGGXSMFNQKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2S/c1-22-19-15-18-17(8-14-24-18)20(23-19)9-12-21(13-10-20)11-7-16-5-3-2-4-6-16/h2-6,8,14,19H,7,9-13,15H2,1H3.
What are the key properties of 6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]?
6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine] has a molecular weight of 343.49 g/mol, XLogP of 3.83, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1'-(2-phenylethyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine] is sourced from PubChem (CID 25129866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).