(3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol

C15H17NO3 — CID 11253942

IUPAC(3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol
SMILESCOc1c2c(nc3ccccc13)OC(C)(C)[C@H](O)C2
InChIInChI=1S/C15H17NO3/c1-15(2)12(17)8-10-13(18-3)9-6-4-5-7-11(9)16-14(10)19-15/h4-7,12,17H,8H2,1-3H3/t12-/m1/s1
InChIKeySQJURFQZMPUMRB-GFCCVEGCSA-N
MW259.31 g/mol
LogP2.32
Rot. Bonds1

About (3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol

(3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol (PubChem CID 11253942) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is (3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol.

Molecular Properties

Compound Name(3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol
PubChem CID11253942
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC Name(3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol
SMILESCOc1c2c(nc3ccccc13)OC(C)(C)[C@H](O)C2
InChIInChI=1S/C15H17NO3/c1-15(2)12(17)8-10-13(18-3)9-6-4-5-7-11(9)16-14(10)19-15/h4-7,12,17H,8H2,1-3H3/t12-/m1/s1
InChIKeySQJURFQZMPUMRB-GFCCVEGCSA-N
XLogP2.32
TPSA51.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,3-Dihydro-4-methoxyfuro(2,3-b)quinolin-2-yl)-1,2-propanediol
CID 442897
1-[4-(Quinolin-2-ylmethoxy)phenyl]hexan-1-ol
CID 9797817
7-ethyl-6H-chromeno[4,3-b]quinoline-3,9-diol
CID 135466462
Platydesmine
CID 6451457
Platydesminium
CID 5319758
Lopac-D-7814
CID 673467
4-(4-Ethoxyquinolin-2-yl)benzene-1,2-diol
CID 136126533
4-(4-Propan-2-yloxyquinolin-2-yl)benzene-1,2-diol
CID 136152768
4-(4-Propan-2-yloxyquinolin-2-yl)benzene-1,3-diol
CID 136152772
2-Hydroxy-2-{4-methoxy-2H,3H-furo[2,3-B]quinolin-2-YL}propyl acetate
CID 3107433
(2S)-2-[(2S)-4-methoxy-2,3-dihydrofuro[2,3-b]quinolin-2-yl]propane-1,2-diol
CID 673469
Methanol, (2,3-dihydro-6-methoxy-4-methyl-2-furo[3,2-c]quinolinyl)-
CID 618527

Frequently Asked Questions

What is the IUPAC name of (3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol?
The IUPAC name of (3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol (CID 11253942) is (3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol.
What is the SMILES notation for (3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol?
The canonical SMILES for (3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol is COc1c2c(nc3ccccc13)OC(C)(C)[C@H](O)C2.
What is the InChIKey of (3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol?
The InChIKey is SQJURFQZMPUMRB-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H17NO3/c1-15(2)12(17)8-10-13(18-3)9-6-4-5-7-11(9)16-14(10)19-15/h4-7,12,17H,8H2,1-3H3/t12-/m1/s1.
What are the key properties of (3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol?
(3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol has a molecular weight of 259.31 g/mol, XLogP of 2.32, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-5-methoxy-2,2-dimethyl-3,4-dihydropyrano[2,3-b]quinolin-3-ol is sourced from PubChem (CID 11253942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).