(6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine

C11H10N2O — CID 87541817

IUPAC(6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine
SMILES[H]/N=C1\C=CC=C\C1=C1\C=CC=CN1O
InChIInChI=1S/C11H10N2O/c12-10-6-2-1-5-9(10)11-7-3-4-8-13(11)14/h1-8,12,14H/b11-9+,12-10+
InChIKeyPKFAIOMSBNXXHF-WGDLNXRISA-N
MW186.21 g/mol
LogP2.16
Rot. Bonds

About (6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine

(6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine (PubChem CID 87541817) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is (6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine.

Molecular Properties

Compound Name(6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine
PubChem CID87541817
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name(6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine
SMILES[H]/N=C1\C=CC=C\C1=C1\C=CC=CN1O
InChIInChI=1S/C11H10N2O/c12-10-6-2-1-5-9(10)11-7-3-4-8-13(11)14/h1-8,12,14H/b11-9+,12-10+
InChIKeyPKFAIOMSBNXXHF-WGDLNXRISA-N
XLogP2.16
TPSA47.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-(Hydroxyamino)quinoline 1-oxide
CID 9577013
Pyridine, 1-oxide, 2-p-aminophenyl-
CID 3723025
Pyridine, 1-oxide, 4-p-aminophenyl-
CID 4401630
2-Hydroxy-3,4-dihydropyrido[3,4-b]indole
CID 14060368
5-Ethyl-1-hydroxy-2-methylpyridin-4-imine
CID 4047219
8-Fluoro-1-hydroxyquinolin-5-imine
CID 66969644
6,8-Difluoro-1-hydroxyquinolin-5-imine
CID 70439420
1-Hydroxy-1,2-dihydropyrroloquinoline
CID 129786515
N-(1-hydroxyquinolin-5-ylidene)hydroxylamine
CID 146491
Benzenamine, N4-oxide
CID 54606662
5-Quinolinamine, 1-oxide
CID 12292892
4-[2-(1-Hydroxy-4-pyridinylidene)ethylidene]cyclohexa-2,5-dien-1-imine
CID 19741860

Frequently Asked Questions

What is the IUPAC name of (6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine?
The IUPAC name of (6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine (CID 87541817) is (6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine.
What is the SMILES notation for (6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine?
The canonical SMILES for (6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine is [H]/N=C1\C=CC=C\C1=C1\C=CC=CN1O.
What is the InChIKey of (6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine?
The InChIKey is PKFAIOMSBNXXHF-WGDLNXRISA-N. The full InChI is InChI=1S/C11H10N2O/c12-10-6-2-1-5-9(10)11-7-3-4-8-13(11)14/h1-8,12,14H/b11-9+,12-10+.
What are the key properties of (6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine?
(6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine has a molecular weight of 186.21 g/mol, XLogP of 2.16, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6E)-6-(1-hydroxy-2-pyridinylidene)cyclohexa-2,4-dien-1-imine is sourced from PubChem (CID 87541817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).