N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine

C12H15NO2 — CID 173464741

IUPACN-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine
SMILESCOc1cc2c(cc1C)C(=NO)CCC2
InChIInChI=1S/C12H15NO2/c1-8-6-10-9(7-12(8)15-2)4-3-5-11(10)13-14/h6-7,14H,3-5H2,1-2H3
InChIKeyUKFBEABRUHFPDP-UHFFFAOYSA-N
MW205.26 g/mol
LogP2.52
Rot. Bonds1

About N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine

N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine (PubChem CID 173464741) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine
PubChem CID173464741
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC NameN-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine
SMILESCOc1cc2c(cc1C)C(=NO)CCC2
InChIInChI=1S/C12H15NO2/c1-8-6-10-9(7-12(8)15-2)4-3-5-11(10)13-14/h6-7,14H,3-5H2,1-2H3
InChIKeyUKFBEABRUHFPDP-UHFFFAOYSA-N
XLogP2.52
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-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 N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine?
The IUPAC name of N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine (CID 173464741) is N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine.
What is the SMILES notation for N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine?
The canonical SMILES for N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine is COc1cc2c(cc1C)C(=NO)CCC2.
What is the InChIKey of N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine?
The InChIKey is UKFBEABRUHFPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-8-6-10-9(7-12(8)15-2)4-3-5-11(10)13-14/h6-7,14H,3-5H2,1-2H3.
What are the key properties of N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine?
N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine has a molecular weight of 205.26 g/mol, XLogP of 2.52, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-7-methyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine is sourced from PubChem (CID 173464741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).