7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol

C28H29NO4 — CID 155535063

IUPAC7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol
SMILESOc1ccc(C2=C(c3ccc(OCCN4CCOCC4)cc3)c3cc(O)ccc3CC2)cc1
InChIInChI=1S/C28H29NO4/c30-23-7-1-20(2-8-23)26-12-6-21-3-9-24(31)19-27(21)28(26)22-4-10-25(11-5-22)33-18-15-29-13-16-32-17-14-29/h1-5,7-11,19,30-31H,6,12-18H2
InChIKeyDNDTVCLTHBYPLR-UHFFFAOYSA-N
MW443.54 g/mol
LogP4.71
Rot. Bonds6

About 7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol

7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol (PubChem CID 155535063) has the molecular formula C28H29NO4 and a molecular weight of 443.54 g/mol. Its IUPAC name is 7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol.

Molecular Properties

Compound Name7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol
PubChem CID155535063
Molecular FormulaC28H29NO4
Molecular Weight443.54 g/mol
Exact Mass443.21
IUPAC Name7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol
SMILESOc1ccc(C2=C(c3ccc(OCCN4CCOCC4)cc3)c3cc(O)ccc3CC2)cc1
InChIInChI=1S/C28H29NO4/c30-23-7-1-20(2-8-23)26-12-6-21-3-9-24(31)19-27(21)28(26)22-4-10-25(11-5-22)33-18-15-29-13-16-32-17-14-29/h1-5,7-11,19,30-31H,6,12-18H2
InChIKeyDNDTVCLTHBYPLR-UHFFFAOYSA-N
XLogP4.71
TPSA62.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.54
LogP ≤ 54.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

7-(4-hydroxyphenyl)-8-[4-[2-[methyl(propyl)amino]ethoxy]phenyl]-5,6-dihydronaphthalen-2-ol
CID 155532894
4-[8-fluoro-5-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-2,3-dihydro-1-benzothiepin-4-yl]phenol
CID 23656715
2-(4-hydroxyphenyl)-7-(2-morpholin-4-ylethoxy)chromen-4-one
CID 162359881
5-[4-(2-hydroxyethoxy)phenyl]-6-pyridin-4-yl-7,8-dihydronaphthalen-2-ol
CID 135439593
methane;4-[2-(4-methylphenoxy)ethyl]morpholine
CID 162149342
4-[2-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]ethyl]morpholine
CID 69000749
[6-hydroxy-2-(4-hydroxyphenyl)-1-benzoselenophen-3-yl]-[4-(2-morpholin-4-ylethoxy)phenyl]methanone
CID 118717362
4-[2-(4-methylphenoxy)ethyl]morpholine;oxalic acid
CID 44827969
4-[2-(2,3-dihydro-1H-isoindol-5-yloxy)ethyl]morpholine
CID 66657088
4-(2-morpholin-4-ylethoxy)aniline;hydrochloride
CID 89422137
4-[2-[4-(3-fluoro-4-methylphenyl)phenoxy]ethyl]morpholine
CID 123641546
4-[2-(4-buta-1,3-dien-2-ylphenoxy)ethyl]morpholine
CID 123489921

Frequently Asked Questions

What is the IUPAC name of 7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol?
The IUPAC name of 7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol (CID 155535063) is 7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol.
What is the SMILES notation for 7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol?
The canonical SMILES for 7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol is Oc1ccc(C2=C(c3ccc(OCCN4CCOCC4)cc3)c3cc(O)ccc3CC2)cc1.
What is the InChIKey of 7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol?
The InChIKey is DNDTVCLTHBYPLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H29NO4/c30-23-7-1-20(2-8-23)26-12-6-21-3-9-24(31)19-27(21)28(26)22-4-10-25(11-5-22)33-18-15-29-13-16-32-17-14-29/h1-5,7-11,19,30-31H,6,12-18H2.
What are the key properties of 7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol?
7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol has a molecular weight of 443.54 g/mol, XLogP of 4.71, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-hydroxyphenyl)-8-[4-(2-morpholin-4-ylethoxy)phenyl]-5,6-dihydronaphthalen-2-ol is sourced from PubChem (CID 155535063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).