3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol

C15H12N2O2 — CID 135433426

IUPAC3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol
SMILESOc1ccc(/N=C/c2c(O)[nH]c3ccccc23)cc1
InChIInChI=1S/C15H12N2O2/c18-11-7-5-10(6-8-11)16-9-13-12-3-1-2-4-14(12)17-15(13)19/h1-9,17-19H/b16-9+
InChIKeyCGZUYJPMUOAKAO-CXUHLZMHSA-N
MW252.27 g/mol
LogP3.33
Rot. Bonds2

About 3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol

3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol (PubChem CID 135433426) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol.

Molecular Properties

Compound Name3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol
PubChem CID135433426
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol
SMILESOc1ccc(/N=C/c2c(O)[nH]c3ccccc23)cc1
InChIInChI=1S/C15H12N2O2/c18-11-7-5-10(6-8-11)16-9-13-12-3-1-2-4-14(12)17-15(13)19/h1-9,17-19H/b16-9+
InChIKeyCGZUYJPMUOAKAO-CXUHLZMHSA-N
XLogP3.33
TPSA68.61 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

3-[3-(phenyliminomethyl)-1H-indol-2-yl]-1H-indol-2-ol
CID 168852579
3-[(3-hydroxy-4-methoxyphenyl)iminomethyl]-1H-indol-2-ol
CID 135605056
1-[3-[(2-hydroxy-1H-indol-3-yl)methylideneamino]phenyl]ethanone
CID 3587554
3-[[4-[methoxymethyl(propyl)amino]phenyl]iminomethyl]-1H-indol-2-ol
CID 135605031
3-[[4-methoxy-3-(trifluoromethyl)phenyl]iminomethyl]-1H-indol-2-ol
CID 135605514
3-[(3-methyl-4-pyrrolidin-1-ylphenyl)iminomethyl]-1H-indol-2-ol
CID 135605363
3-(2-hydroxyethyliminomethyl)-1H-indol-2-ol
CID 2034851
3-[(2-chloro-4,6-dimethylphenyl)iminomethyl]-1H-indol-2-ol
CID 136995976
4-[(5-methoxy-2-phenyl-1H-indol-3-yl)methylideneamino]phenol
CID 137107988
3-[(E)-(4-bromo-1H-pyrazol-5-yl)iminomethyl]-1H-indol-2-ol
CID 135697873
3-[(4-bromo-2-fluorophenyl)iminomethyl]-1H-indol-2-ol
CID 4195029
5-bromo-3-[(4-chlorophenyl)iminomethyl]-1H-indol-2-ol
CID 137006304

Frequently Asked Questions

What is the IUPAC name of 3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol?
The IUPAC name of 3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol (CID 135433426) is 3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol.
What is the SMILES notation for 3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol?
The canonical SMILES for 3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol is Oc1ccc(/N=C/c2c(O)[nH]c3ccccc23)cc1.
What is the InChIKey of 3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol?
The InChIKey is CGZUYJPMUOAKAO-CXUHLZMHSA-N. The full InChI is InChI=1S/C15H12N2O2/c18-11-7-5-10(6-8-11)16-9-13-12-3-1-2-4-14(12)17-15(13)19/h1-9,17-19H/b16-9+.
What are the key properties of 3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol?
3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol has a molecular weight of 252.27 g/mol, XLogP of 3.33, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-hydroxyphenyl)iminomethyl]-1H-indol-2-ol is sourced from PubChem (CID 135433426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).