4-methylisoquinolin-7-ol

C10H9NO — CID 20523221

IUPAC4-methylisoquinolin-7-ol
SMILESCc1cncc2cc(O)ccc12
InChIInChI=1S/C10H9NO/c1-7-5-11-6-8-4-9(12)2-3-10(7)8/h2-6,12H,1H3
InChIKeySMNGTNDMNRGKMA-UHFFFAOYSA-N
MW159.19 g/mol
LogP2.25
Rot. Bonds

About 4-methylisoquinolin-7-ol

4-methylisoquinolin-7-ol (PubChem CID 20523221) has the molecular formula C10H9NO and a molecular weight of 159.19 g/mol. Its IUPAC name is 4-methylisoquinolin-7-ol.

Molecular Properties

Compound Name4-methylisoquinolin-7-ol
PubChem CID20523221
Molecular FormulaC10H9NO
Molecular Weight159.19 g/mol
Exact Mass159.07
IUPAC Name4-methylisoquinolin-7-ol
SMILESCc1cncc2cc(O)ccc12
InChIInChI=1S/C10H9NO/c1-7-5-11-6-8-4-9(12)2-3-10(7)8/h2-6,12H,1H3
InChIKeySMNGTNDMNRGKMA-UHFFFAOYSA-N
XLogP2.25
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Methyl-8-hydroxyquinoline
CID 71208
4,4'-Dihydroxydiphenyl(2-pyridyl)methane
CID 69046
Isoquinolin-5-ol
CID 30386
Papaveroline
CID 5459346
4-Isoquinolinol
CID 18750
6-Hydroxyquinoline
CID 11374
3-Pyridinol, 5-benzyl-
CID 796726
4-Methyl-8-hydroxyquinoline
CID 345169
3-Methylquinolin-8-ol
CID 4332281
8-Hydroxyisoquinoline
CID 135441711
6-Pyridin-3-ylnaphthalen-2-ol
CID 11514074
5-(1,1-Dimethyl-heptyl)-2-pyridin-3-yl-phenol
CID 11551123

Frequently Asked Questions

What is the IUPAC name of 4-methylisoquinolin-7-ol?
The IUPAC name of 4-methylisoquinolin-7-ol (CID 20523221) is 4-methylisoquinolin-7-ol.
What is the SMILES notation for 4-methylisoquinolin-7-ol?
The canonical SMILES for 4-methylisoquinolin-7-ol is Cc1cncc2cc(O)ccc12.
What is the InChIKey of 4-methylisoquinolin-7-ol?
The InChIKey is SMNGTNDMNRGKMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO/c1-7-5-11-6-8-4-9(12)2-3-10(7)8/h2-6,12H,1H3.
What are the key properties of 4-methylisoquinolin-7-ol?
4-methylisoquinolin-7-ol has a molecular weight of 159.19 g/mol, XLogP of 2.25, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylisoquinolin-7-ol is sourced from PubChem (CID 20523221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).