(NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine

C19H13NO2 — CID 155510681

IUPAC(NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine
SMILESO/N=c1\cc(-c2ccccc2)oc2c1ccc1ccccc12
InChIInChI=1S/C19H13NO2/c21-20-17-12-18(14-7-2-1-3-8-14)22-19-15-9-5-4-6-13(15)10-11-16(17)19/h1-12,21H/b20-17+
InChIKeyYITNDIKCLAWTFT-LVZFUZTISA-N
MW287.32 g/mol
LogP4.54
Rot. Bonds1

About (NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine

(NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine (PubChem CID 155510681) has the molecular formula C19H13NO2 and a molecular weight of 287.32 g/mol. Its IUPAC name is (NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine.

Molecular Properties

Compound Name(NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine
PubChem CID155510681
Molecular FormulaC19H13NO2
Molecular Weight287.32 g/mol
Exact Mass287.09
IUPAC Name(NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine
SMILESO/N=c1\cc(-c2ccccc2)oc2c1ccc1ccccc12
InChIInChI=1S/C19H13NO2/c21-20-17-12-18(14-7-2-1-3-8-14)22-19-15-9-5-4-6-13(15)10-11-16(17)19/h1-12,21H/b20-17+
InChIKeyYITNDIKCLAWTFT-LVZFUZTISA-N
XLogP4.54
TPSA45.73 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze (NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine?
The IUPAC name of (NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine (CID 155510681) is (NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine.
What is the SMILES notation for (NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine?
The canonical SMILES for (NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine is O/N=c1\cc(-c2ccccc2)oc2c1ccc1ccccc12.
What is the InChIKey of (NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine?
The InChIKey is YITNDIKCLAWTFT-LVZFUZTISA-N. The full InChI is InChI=1S/C19H13NO2/c21-20-17-12-18(14-7-2-1-3-8-14)22-19-15-9-5-4-6-13(15)10-11-16(17)19/h1-12,21H/b20-17+.
What are the key properties of (NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine?
(NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine has a molecular weight of 287.32 g/mol, XLogP of 4.54, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-(2-phenylbenzo[h]chromen-4-ylidene)hydroxylamine is sourced from PubChem (CID 155510681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).