6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol

C15H21NO3 — CID 59620250

IUPAC6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
SMILESCOc1ccc2c(c1)C(O)CC1(CCN(C)CC1)O2
InChIInChI=1S/C15H21NO3/c1-16-7-5-15(6-8-16)10-13(17)12-9-11(18-2)3-4-14(12)19-15/h3-4,9,13,17H,5-8,10H2,1-2H3
InChIKeySMBHGEQQWRCCTL-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.98
Rot. Bonds1

About 6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol

6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol (PubChem CID 59620250) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol.

Molecular Properties

Compound Name6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
PubChem CID59620250
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
SMILESCOc1ccc2c(c1)C(O)CC1(CCN(C)CC1)O2
InChIInChI=1S/C15H21NO3/c1-16-7-5-15(6-8-16)10-13(17)12-9-11(18-2)3-4-14(12)19-15/h3-4,9,13,17H,5-8,10H2,1-2H3
InChIKeySMBHGEQQWRCCTL-UHFFFAOYSA-N
XLogP1.98
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-azepane]-4-ol
CID 114715390
(4S)-6-methoxy-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 104950732
(4S)-6-methoxyspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 104950862
(4R)-6-methoxy-1',1'-dioxospiro[3,4-dihydrochromene-2,4'-thiane]-4-ol
CID 104950989
6-methoxy-1',1'-dioxospiro[3,4-dihydrochromene-2,4'-thiane]-4-ol
CID 114715358
(4S)-6-methoxy-4'-propan-2-ylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 104950824
(4S)-3',6-dimethoxyspiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-ol
CID 106825058
(4S)-7-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
CID 96653094
4-[2-[(4S)-4-hydroxy-6-methoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-1'-yl]ethyl]benzonitrile;hydrochloride
CID 67695837
(4S)-6-chloro-1'-methylspiro[3,4-dihydrochromene-2,4'-azepane]-4-ol
CID 104948992
(4S)-1'-ethyl-7-methoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 104948800
(4S)-6-methoxy-2'-methylspiro[3,4-dihydrochromene-2,4'-thiolane]-4-ol
CID 104950800

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol?
The IUPAC name of 6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol (CID 59620250) is 6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol.
What is the SMILES notation for 6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol?
The canonical SMILES for 6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol is COc1ccc2c(c1)C(O)CC1(CCN(C)CC1)O2.
What is the InChIKey of 6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol?
The InChIKey is SMBHGEQQWRCCTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-16-7-5-15(6-8-16)10-13(17)12-9-11(18-2)3-4-14(12)19-15/h3-4,9,13,17H,5-8,10H2,1-2H3.
What are the key properties of 6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol?
6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol has a molecular weight of 263.34 g/mol, XLogP of 1.98, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol is sourced from PubChem (CID 59620250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).