(6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol

C11H10N2O — CID 177400195

IUPAC(6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol
SMILES[H]/N=C/C1=Cc2c/c(=C/N)c(O)cc2=C1
InChIInChI=1S/C11H10N2O/c12-5-7-1-8-3-10(6-13)11(14)4-9(8)2-7/h1-6,12,14H,13H2/b10-6-,12-5+
InChIKeyVAVNTQJPHCGJTP-PMCUVYCNSA-N
MW186.21 g/mol
LogP-0.08
Rot. Bonds1

About (6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol

(6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol (PubChem CID 177400195) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is (6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol.

Molecular Properties

Compound Name(6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol
PubChem CID177400195
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name(6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol
SMILES[H]/N=C/C1=Cc2c/c(=C/N)c(O)cc2=C1
InChIInChI=1S/C11H10N2O/c12-5-7-1-8-3-10(6-13)11(14)4-9(8)2-7/h1-6,12,14H,13H2/b10-6-,12-5+
InChIKeyVAVNTQJPHCGJTP-PMCUVYCNSA-N
XLogP-0.08
TPSA70.10 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-0.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-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

6-Methanimidoyl-2-methylideneinden-5-ol
CID 101845325
2-Imino-5-methanimidoylinden-4-ol
CID 136883634
5-Methanimidoyl-2-methylideneinden-4-ol
CID 136883636
2-Imino-6-methanimidoylinden-5-ol
CID 136883638
(3E)-3-(aminomethylidene)-5-(methyliminomethyl)cyclopenta-1,4-dien-1-ol
CID 177405657
(2Z)-2-(dimethylaminomethylidene)-5-methanimidoylinden-4-ol
CID 177419407
(5E)-5-(aminomethylidene)-2-methanimidoylinden-4-ol
CID 177526826
(2E)-2-(dimethylaminomethylidene)-6-methanimidoylinden-5-ol
CID 177575841

Frequently Asked Questions

What is the IUPAC name of (6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol?
The IUPAC name of (6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol (CID 177400195) is (6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol.
What is the SMILES notation for (6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol?
The canonical SMILES for (6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol is [H]/N=C/C1=Cc2c/c(=C/N)c(O)cc2=C1.
What is the InChIKey of (6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol?
The InChIKey is VAVNTQJPHCGJTP-PMCUVYCNSA-N. The full InChI is InChI=1S/C11H10N2O/c12-5-7-1-8-3-10(6-13)11(14)4-9(8)2-7/h1-6,12,14H,13H2/b10-6-,12-5+.
What are the key properties of (6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol?
(6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol has a molecular weight of 186.21 g/mol, XLogP of -0.08, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-6-(aminomethylidene)-2-methanimidoylinden-5-ol is sourced from PubChem (CID 177400195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).