7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol

C16H23NO4 — CID 82187477

IUPAC7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol
SMILESCOc1ccc2c(c1)OC(C)(C)C(N1CCOCC1)C2O
InChIInChI=1S/C16H23NO4/c1-16(2)15(17-6-8-20-9-7-17)14(18)12-5-4-11(19-3)10-13(12)21-16/h4-5,10,14-15,18H,6-9H2,1-3H3
InChIKeyKQODUYXEQBDXAR-UHFFFAOYSA-N
MW293.36 g/mol
LogP1.60
Rot. Bonds2

About 7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol

7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol (PubChem CID 82187477) has the molecular formula C16H23NO4 and a molecular weight of 293.36 g/mol. Its IUPAC name is 7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol.

Molecular Properties

Compound Name7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol
PubChem CID82187477
Molecular FormulaC16H23NO4
Molecular Weight293.36 g/mol
Exact Mass293.16
IUPAC Name7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol
SMILESCOc1ccc2c(c1)OC(C)(C)C(N1CCOCC1)C2O
InChIInChI=1S/C16H23NO4/c1-16(2)15(17-6-8-20-9-7-17)14(18)12-5-4-11(19-3)10-13(12)21-16/h4-5,10,14-15,18H,6-9H2,1-3H3
InChIKeyKQODUYXEQBDXAR-UHFFFAOYSA-N
XLogP1.60
TPSA51.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-ethoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol
CID 82187460
2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol
CID 82187161
3-[2-hydroxyethyl(methyl)amino]-7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-ol
CID 82187476
3-(azepan-1-yl)-2,2-dimethyl-3,4-dihydrochromen-4-ol
CID 82187151
3-amino-7-methoxyspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 82020765
(3S,4R)-6-methoxy-2,2-dimethyl-4-pyrrolidin-1-yl-3,4-dihydrochromen-3-ol;hydrochloride
CID 13223035
5-methoxy-2,2-dimethyl-3-pyrrolidin-1-yl-3,4-dihydrochromen-4-ol
CID 82187518
(4S)-7-methoxy-2-methyl-2-pentyl-3,4-dihydrochromen-4-ol
CID 104948818
(4R)-7-methoxy-2-methyl-2-(3-methylbutyl)-3,4-dihydrochromen-4-ol
CID 104948574
(4S)-1'-ethyl-7-methoxyspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 104948800
(4R)-3',7-dimethoxyspiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-ol
CID 106825043
(4S)-2-cyclopropyl-7-methoxy-2-methyl-3,4-dihydrochromen-4-ol
CID 104948836

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol?
The IUPAC name of 7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol (CID 82187477) is 7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol.
What is the SMILES notation for 7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol?
The canonical SMILES for 7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol is COc1ccc2c(c1)OC(C)(C)C(N1CCOCC1)C2O.
What is the InChIKey of 7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol?
The InChIKey is KQODUYXEQBDXAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO4/c1-16(2)15(17-6-8-20-9-7-17)14(18)12-5-4-11(19-3)10-13(12)21-16/h4-5,10,14-15,18H,6-9H2,1-3H3.
What are the key properties of 7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol?
7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol has a molecular weight of 293.36 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol is sourced from PubChem (CID 82187477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).