(4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol

C17H24O4 — CID 104948592

IUPAC(4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol
SMILESCCCC1CC2(CCO1)C[C@@H](O)c1ccc(OC)cc1O2
InChIInChI=1S/C17H24O4/c1-3-4-13-10-17(7-8-20-13)11-15(18)14-6-5-12(19-2)9-16(14)21-17/h5-6,9,13,15,18H,3-4,7-8,10-11H2,1-2H3/t13?,15-,17?/m1/s1
InChIKeyDPHVBZNCORNQFD-GNHJJJEISA-N
MW292.38 g/mol
LogP3.23
Rot. Bonds3

About (4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol

(4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol (PubChem CID 104948592) has the molecular formula C17H24O4 and a molecular weight of 292.38 g/mol. Its IUPAC name is (4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol.

Molecular Properties

Compound Name(4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol
PubChem CID104948592
Molecular FormulaC17H24O4
Molecular Weight292.38 g/mol
Exact Mass292.17
IUPAC Name(4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol
SMILESCCCC1CC2(CCO1)C[C@@H](O)c1ccc(OC)cc1O2
InChIInChI=1S/C17H24O4/c1-3-4-13-10-17(7-8-20-13)11-15(18)14-6-5-12(19-2)9-16(14)21-17/h5-6,9,13,15,18H,3-4,7-8,10-11H2,1-2H3/t13?,15-,17?/m1/s1
InChIKeyDPHVBZNCORNQFD-GNHJJJEISA-N
XLogP3.23
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol with MolForge

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Related Compounds

(4S)-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol
CID 104949919
(4S)-1'-ethyl-7-methoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 104948800
(4S)-1'-ethyl-7-methoxyspiro[3,4-dihydrochromene-2,4'-azepane]-4-ol
CID 104948786
(4R)-3'-ethyl-7-methoxyspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 104948654
(4R)-3',7-dimethoxyspiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-ol
CID 106825043
3',7-dimethoxyspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 106875058
(4S)-7-methoxy-3',5'-dimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 104948842
7-methoxyspiro[3,4-dihydrochromene-2,3'-pyrrolidine]-4-ol
CID 82045910
7-methoxy-2-propyl-3,4-dihydro-2H-chromen-4-ol
CID 114714331
N-ethyl-7-methoxy-2'-methylspiro[3,4-dihydrochromene-2,4'-oxane]-4-amine
CID 114711043
(4S)-7-methoxy-2-methyl-2-pentyl-3,4-dihydrochromen-4-ol
CID 104948818
(4S)-6-methoxy-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 104950732

Frequently Asked Questions

What is the IUPAC name of (4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol?
The IUPAC name of (4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol (CID 104948592) is (4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol.
What is the SMILES notation for (4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol?
The canonical SMILES for (4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol is CCCC1CC2(CCO1)C[C@@H](O)c1ccc(OC)cc1O2.
What is the InChIKey of (4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol?
The InChIKey is DPHVBZNCORNQFD-GNHJJJEISA-N. The full InChI is InChI=1S/C17H24O4/c1-3-4-13-10-17(7-8-20-13)11-15(18)14-6-5-12(19-2)9-16(14)21-17/h5-6,9,13,15,18H,3-4,7-8,10-11H2,1-2H3/t13?,15-,17?/m1/s1.
What are the key properties of (4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol?
(4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol has a molecular weight of 292.38 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-7-methoxy-2'-propylspiro[3,4-dihydrochromene-2,4'-oxane]-4-ol is sourced from PubChem (CID 104948592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).