(4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol

C15H21NO3 — CID 93174887

IUPAC(4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
SMILESCCOc1ccc2c(c1)[C@H](O)CC1(CCNCC1)O2
InChIInChI=1S/C15H21NO3/c1-2-18-11-3-4-14-12(9-11)13(17)10-15(19-14)5-7-16-8-6-15/h3-4,9,13,16-17H,2,5-8,10H2,1H3/t13-/m1/s1
InChIKeyZJKWCWKYUHIRJF-CYBMUJFWSA-N
MW263.34 g/mol
LogP2.02
Rot. Bonds2

About (4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol

(4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol (PubChem CID 93174887) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is (4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol.

Molecular Properties

Compound Name(4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
PubChem CID93174887
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name(4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
SMILESCCOc1ccc2c(c1)[C@H](O)CC1(CCNCC1)O2
InChIInChI=1S/C15H21NO3/c1-2-18-11-3-4-14-12(9-11)13(17)10-15(19-14)5-7-16-8-6-15/h3-4,9,13,16-17H,2,5-8,10H2,1H3/t13-/m1/s1
InChIKeyZJKWCWKYUHIRJF-CYBMUJFWSA-N
XLogP2.02
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-ethoxy-N,N-dimethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
CID 82046925
6-ethoxy-4-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]
CID 82047218
6-fluorospiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 82045746
(4S)-6-methoxyspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 104950862
(4S)-6-ethoxyspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 42130108
(4S)-6-methoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
CID 104946767
(4S)-6-methoxy-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 104950732
6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 59620250
(4S)-4'-ethyl-6-methoxyspiro[3,4-dihydrochromene-2,1'-cycloheptane]-4-ol
CID 104950848
6-chloro-7-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 82045751
6-butoxy-2,2-dimethyl-3,4-dihydrochromen-4-ol
CID 11831848
7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol
CID 82045910

Frequently Asked Questions

What is the IUPAC name of (4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol?
The IUPAC name of (4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol (CID 93174887) is (4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol.
What is the SMILES notation for (4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol?
The canonical SMILES for (4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol is CCOc1ccc2c(c1)[C@H](O)CC1(CCNCC1)O2.
What is the InChIKey of (4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol?
The InChIKey is ZJKWCWKYUHIRJF-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H21NO3/c1-2-18-11-3-4-14-12(9-11)13(17)10-15(19-14)5-7-16-8-6-15/h3-4,9,13,16-17H,2,5-8,10H2,1H3/t13-/m1/s1.
What are the key properties of (4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol?
(4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol has a molecular weight of 263.34 g/mol, XLogP of 2.02, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-6-ethoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol is sourced from PubChem (CID 93174887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).