7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol

C17H18O4 — CID 114714285

IUPAC7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol
SMILESCOc1ccc2c(c1)OC(c1ccccc1OC)CC2O
InChIInChI=1S/C17H18O4/c1-19-11-7-8-12-14(18)10-17(21-16(12)9-11)13-5-3-4-6-15(13)20-2/h3-9,14,17-18H,10H2,1-2H3
InChIKeyDAHSXNQODBSHOO-UHFFFAOYSA-N
MW286.33 g/mol
LogP3.26
Rot. Bonds3

About 7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol

7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol (PubChem CID 114714285) has the molecular formula C17H18O4 and a molecular weight of 286.33 g/mol. Its IUPAC name is 7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol.

Molecular Properties

Compound Name7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol
PubChem CID114714285
Molecular FormulaC17H18O4
Molecular Weight286.33 g/mol
Exact Mass286.12
IUPAC Name7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol
SMILESCOc1ccc2c(c1)OC(c1ccccc1OC)CC2O
InChIInChI=1S/C17H18O4/c1-19-11-7-8-12-14(18)10-17(21-16(12)9-11)13-5-3-4-6-15(13)20-2/h3-9,14,17-18H,10H2,1-2H3
InChIKeyDAHSXNQODBSHOO-UHFFFAOYSA-N
XLogP3.26
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4S)-6-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 104950789
(4S)-7-methoxy-2-phenyl-3,4-dihydro-2H-chromen-4-ol
CID 104948683
(4R)-7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-amine
CID 104944809
7-methoxy-2-(3-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 114714356
2-(2-methoxyphenyl)-3,4-dihydro-2H-chromene-4,6-diol
CID 161182223
2-(2,4-dimethylphenyl)-7-methoxy-3,4-dihydro-2H-chromen-4-ol
CID 114714374
6-chloro-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 114714479
2-(3-hydroxyphenyl)-7-methoxy-3,4-dihydro-2H-chromen-4-ol
CID 114714377
(4R)-6-chloro-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 104949171
2-(4-bromo-5-methylthiophen-2-yl)-7-methoxy-3,4-dihydro-2H-chromen-4-ol
CID 102845963
[3-[(2R,4S)-4-hydroxy-7-methoxy-3,4-dihydro-2H-chromen-2-yl]phenyl] acetate
CID 821291
7-bromo-2-(2-ethoxyphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 114714756

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol?
The IUPAC name of 7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol (CID 114714285) is 7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol.
What is the SMILES notation for 7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol?
The canonical SMILES for 7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol is COc1ccc2c(c1)OC(c1ccccc1OC)CC2O.
What is the InChIKey of 7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol?
The InChIKey is DAHSXNQODBSHOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O4/c1-19-11-7-8-12-14(18)10-17(21-16(12)9-11)13-5-3-4-6-15(13)20-2/h3-9,14,17-18H,10H2,1-2H3.
What are the key properties of 7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol?
7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol has a molecular weight of 286.33 g/mol, XLogP of 3.26, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2-(2-methoxyphenyl)-3,4-dihydro-2H-chromen-4-ol is sourced from PubChem (CID 114714285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).