7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol

C13H17NO3 — CID 82045910

IUPAC7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol
SMILESCOc1ccc2c(c1)OC1(CCNC1)CC2O
InChIInChI=1S/C13H17NO3/c1-16-9-2-3-10-11(15)7-13(4-5-14-8-13)17-12(10)6-9/h2-3,6,11,14-15H,4-5,7-8H2,1H3
InChIKeyFCLSXDRKMAQHSB-UHFFFAOYSA-N
MW235.28 g/mol
LogP1.24
Rot. Bonds1

About 7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol

7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol (PubChem CID 82045910) has the molecular formula C13H17NO3 and a molecular weight of 235.28 g/mol. Its IUPAC name is 7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol.

Molecular Properties

Compound Name7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol
PubChem CID82045910
Molecular FormulaC13H17NO3
Molecular Weight235.28 g/mol
Exact Mass235.12
IUPAC Name7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol
SMILESCOc1ccc2c(c1)OC1(CCNC1)CC2O
InChIInChI=1S/C13H17NO3/c1-16-9-2-3-10-11(15)7-13(4-5-14-8-13)17-12(10)6-9/h2-3,6,11,14-15H,4-5,7-8H2,1H3
InChIKeyFCLSXDRKMAQHSB-UHFFFAOYSA-N
XLogP1.24
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol with MolForge

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Related Compounds

(4R)-3',7-dimethoxyspiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-ol
CID 106825043
(4S)-7-methoxy-3',5'-dimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 104948842
3',7-dimethoxyspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 106875058
(4S)-1'-ethyl-7-methoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 104948800
(4R)-3'-ethyl-7-methoxyspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 104948654
(4S)-6-methoxyspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 104950862
(4S)-1'-ethyl-7-methoxyspiro[3,4-dihydrochromene-2,4'-azepane]-4-ol
CID 104948786
(4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol
CID 104948592
6-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine];hydrochloride
CID 121207060
(4S)-7-fluorospiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 104951801
(4S)-7-methoxy-2'-methylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 104948820
(4S)-2-cyclopropyl-7-methoxy-2-methyl-3,4-dihydrochromen-4-ol
CID 104948836

Frequently Asked Questions

What is the IUPAC name of 7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol?
The IUPAC name of 7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol (CID 82045910) is 7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol.
What is the SMILES notation for 7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol?
The canonical SMILES for 7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol is COc1ccc2c(c1)OC1(CCNC1)CC2O.
What is the InChIKey of 7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol?
The InChIKey is FCLSXDRKMAQHSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO3/c1-16-9-2-3-10-11(15)7-13(4-5-14-8-13)17-12(10)6-9/h2-3,6,11,14-15H,4-5,7-8H2,1H3.
What are the key properties of 7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol?
7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol has a molecular weight of 235.28 g/mol, XLogP of 1.24, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol is sourced from PubChem (CID 82045910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).