(7-methoxyisoquinolin-8-yl)methanol

C11H11NO2 — CID 82576311

IUPAC(7-methoxyisoquinolin-8-yl)methanol
SMILESCOc1ccc2ccncc2c1CO
InChIInChI=1S/C11H11NO2/c1-14-11-3-2-8-4-5-12-6-9(8)10(11)7-13/h2-6,13H,7H2,1H3
InChIKeyXCCAHDSRAXQPPA-UHFFFAOYSA-N
MW189.21 g/mol
LogP1.74
Rot. Bonds2

About (7-methoxyisoquinolin-8-yl)methanol

(7-methoxyisoquinolin-8-yl)methanol (PubChem CID 82576311) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is (7-methoxyisoquinolin-8-yl)methanol.

Molecular Properties

Compound Name(7-methoxyisoquinolin-8-yl)methanol
PubChem CID82576311
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name(7-methoxyisoquinolin-8-yl)methanol
SMILESCOc1ccc2ccncc2c1CO
InChIInChI=1S/C11H11NO2/c1-14-11-3-2-8-4-5-12-6-9(8)10(11)7-13/h2-6,13H,7H2,1H3
InChIKeyXCCAHDSRAXQPPA-UHFFFAOYSA-N
XLogP1.74
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-methoxy-N-methylisoquinolin-8-amine
CID 82582632
7-methoxyisoquinoline-8-carbaldehyde
CID 82573729
(2-methoxyanthracen-1-yl)methanol
CID 102344428
2,9-phenanthroline
CID 23271029
isoquinolin-8-yl-(3-methoxy-4-pyridinyl)methanol
CID 103139118
8,44-diazadodecacyclo[24.24.0.02,23.03,20.04,17.05,14.06,11.029,50.032,49.035,48.038,47.041,46]pentaconta-1(26),2(23),3(20),4(17),5(14),6(11),7,9,12,15,18,21,24,27,29(50),30,32(49),33,35(48),36,38(47),39,41(46),42,44-pentacosaene
CID 122389532
6-bromo-2-methoxy-1-methylnaphthalene;(6-bromo-2-methoxynaphthalen-1-yl)methanol
CID 70197174
6-methoxyisoquinoline-5-carboxamide
CID 82573912
7-[(8-hydroxy-6-methoxyisoquinolin-5-yl)methyl]-6-methoxyisoquinolin-8-ol
CID 170990206
1-(7-methoxyisoquinolin-8-yl)piperidin-4-amine
CID 82582646
(2,3-dibromo-6-methoxyphenyl)methanol
CID 171002454
2,6-naphthyridin-4-ylmethanol
CID 84651029

Frequently Asked Questions

What is the IUPAC name of (7-methoxyisoquinolin-8-yl)methanol?
The IUPAC name of (7-methoxyisoquinolin-8-yl)methanol (CID 82576311) is (7-methoxyisoquinolin-8-yl)methanol.
What is the SMILES notation for (7-methoxyisoquinolin-8-yl)methanol?
The canonical SMILES for (7-methoxyisoquinolin-8-yl)methanol is COc1ccc2ccncc2c1CO.
What is the InChIKey of (7-methoxyisoquinolin-8-yl)methanol?
The InChIKey is XCCAHDSRAXQPPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c1-14-11-3-2-8-4-5-12-6-9(8)10(11)7-13/h2-6,13H,7H2,1H3.
What are the key properties of (7-methoxyisoquinolin-8-yl)methanol?
(7-methoxyisoquinolin-8-yl)methanol has a molecular weight of 189.21 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methoxyisoquinolin-8-yl)methanol is sourced from PubChem (CID 82576311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).