benzo[cd]indol-3-ol

C11H7NO — CID 135922640

IUPACbenzo[cd]indol-3-ol
SMILESOc1ccc2cccc3c2c1C=N3
InChIInChI=1S/C11H7NO/c13-10-5-4-7-2-1-3-9-11(7)8(10)6-12-9/h1-6,13H
InChIKeyOPEWEGSXHBOCSP-UHFFFAOYSA-N
MW169.18 g/mol
LogP2.61
Rot. Bonds

About benzo[cd]indol-3-ol

benzo[cd]indol-3-ol (PubChem CID 135922640) has the molecular formula C11H7NO and a molecular weight of 169.18 g/mol. Its IUPAC name is benzo[cd]indol-3-ol.

Molecular Properties

Compound Namebenzo[cd]indol-3-ol
PubChem CID135922640
Molecular FormulaC11H7NO
Molecular Weight169.18 g/mol
Exact Mass169.05
IUPAC Namebenzo[cd]indol-3-ol
SMILESOc1ccc2cccc3c2c1C=N3
InChIInChI=1S/C11H7NO/c13-10-5-4-7-2-1-3-9-11(7)8(10)6-12-9/h1-6,13H
InChIKeyOPEWEGSXHBOCSP-UHFFFAOYSA-N
XLogP2.61
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-Hydroxyphenyliminomethyl)-2-naphthol
CID 269970
1-(((2-Hydroxyphenyl)imino)methyl)-2-naphthalenol
CID 85895
1-((5-Tert-butyl-2-hydroxyphenyl)iminomethyl)-2-napthol
CID 825674
1-(Anilinomethylidene)-2-naphthalenone
CID 269969
2-(Naphthalen-1-yliminomethyl)-phenol
CID 690983
3-[(E)-(naphthalen-1-ylimino)methyl]benzene-1,2-diol
CID 792072
Mls002920165
CID 280649
1-{(E)-[(2-hydroxy-5-propylphenyl)imino]methyl}naphthalen-2-ol
CID 1625910
1-{(E)-[(4-vinylphenyl)imino]methyl}-2-naphthol
CID 4445693
Nsc305935
CID 328192
1-(((4-Iodophenyl)imino)methyl)naphthalen-2-ol
CID 1083504
1-(O-Tolyliminomethyl)-2-naphthol
CID 548604

Frequently Asked Questions

What is the IUPAC name of benzo[cd]indol-3-ol?
The IUPAC name of benzo[cd]indol-3-ol (CID 135922640) is benzo[cd]indol-3-ol.
What is the SMILES notation for benzo[cd]indol-3-ol?
The canonical SMILES for benzo[cd]indol-3-ol is Oc1ccc2cccc3c2c1C=N3.
What is the InChIKey of benzo[cd]indol-3-ol?
The InChIKey is OPEWEGSXHBOCSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7NO/c13-10-5-4-7-2-1-3-9-11(7)8(10)6-12-9/h1-6,13H.
What are the key properties of benzo[cd]indol-3-ol?
benzo[cd]indol-3-ol has a molecular weight of 169.18 g/mol, XLogP of 2.61, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzo[cd]indol-3-ol is sourced from PubChem (CID 135922640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).