1H-benzo[de]quinolin-4-ol

C12H9NO — CID 91044131

IUPAC1H-benzo[de]quinolin-4-ol
SMILESOc1ccc2cccc3c2c1C=CN3
InChIInChI=1S/C12H9NO/c14-11-5-4-8-2-1-3-10-12(8)9(11)6-7-13-10/h1-7,13-14H
InChIKeyIJOYYVLVBBJXEZ-UHFFFAOYSA-N
MW183.21 g/mol
LogP2.94
Rot. Bonds

About 1H-benzo[de]quinolin-4-ol

1H-benzo[de]quinolin-4-ol (PubChem CID 91044131) has the molecular formula C12H9NO and a molecular weight of 183.21 g/mol. Its IUPAC name is 1H-benzo[de]quinolin-4-ol.

Molecular Properties

Compound Name1H-benzo[de]quinolin-4-ol
PubChem CID91044131
Molecular FormulaC12H9NO
Molecular Weight183.21 g/mol
Exact Mass183.07
IUPAC Name1H-benzo[de]quinolin-4-ol
SMILESOc1ccc2cccc3c2c1C=CN3
InChIInChI=1S/C12H9NO/c14-11-5-4-8-2-1-3-10-12(8)9(11)6-7-13-10/h1-7,13-14H
InChIKeyIJOYYVLVBBJXEZ-UHFFFAOYSA-N
XLogP2.94
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1H-benzo[de]quinolin-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-(1H-benzo[de]quinolin-4-yl)phenyl]propan-2-ol
CID 130444702
benzo[cd]indol-3-ol
CID 135922640
8-sulfanylnaphthalene-1,2-diol
CID 142855011
pyrene;dihydrobromide
CID 172822251
pyrene;zirconium
CID 175873743
benzene-1,2-diol;perylene
CID 175494116
perylene-1,10-diol
CID 139257662
benzene;bis(propan-2-ol);bis(pyren-1-ol)
CID 158038310
9-hydroxy-2,3-dihydrophenalen-1-one
CID 145294882
2-bromonaphthalene-1,8-diol
CID 23297382
hexahelicen-1-ol
CID 102137730
2,3-Dihydro-1H-naphtho[1,8-de][1,3,2]diazaborinine
CID 46868449

Frequently Asked Questions

What is the IUPAC name of 1H-benzo[de]quinolin-4-ol?
The IUPAC name of 1H-benzo[de]quinolin-4-ol (CID 91044131) is 1H-benzo[de]quinolin-4-ol.
What is the SMILES notation for 1H-benzo[de]quinolin-4-ol?
The canonical SMILES for 1H-benzo[de]quinolin-4-ol is Oc1ccc2cccc3c2c1C=CN3.
What is the InChIKey of 1H-benzo[de]quinolin-4-ol?
The InChIKey is IJOYYVLVBBJXEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9NO/c14-11-5-4-8-2-1-3-10-12(8)9(11)6-7-13-10/h1-7,13-14H.
What are the key properties of 1H-benzo[de]quinolin-4-ol?
1H-benzo[de]quinolin-4-ol has a molecular weight of 183.21 g/mol, XLogP of 2.94, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-benzo[de]quinolin-4-ol is sourced from PubChem (CID 91044131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).