N-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine

C16H15NO — CID 58794270

IUPACN-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine
SMILESON=C1CCCc2ccc(-c3ccccc3)cc21
InChIInChI=1S/C16H15NO/c18-17-16-8-4-7-13-9-10-14(11-15(13)16)12-5-2-1-3-6-12/h1-3,5-6,9-11,18H,4,7-8H2
InChIKeyOVXZMHWFIDGVOX-UHFFFAOYSA-N
MW237.30 g/mol
LogP3.87
Rot. Bonds1

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

N-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine (PubChem CID 58794270) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is N-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine
PubChem CID58794270
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC NameN-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine
SMILESON=C1CCCc2ccc(-c3ccccc3)cc21
InChIInChI=1S/C16H15NO/c18-17-16-8-4-7-13-9-10-14(11-15(13)16)12-5-2-1-3-6-12/h1-3,5-6,9-11,18H,4,7-8H2
InChIKeyOVXZMHWFIDGVOX-UHFFFAOYSA-N
XLogP3.87
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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'}

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Frequently Asked Questions

What is the IUPAC name of N-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine?
The IUPAC name of N-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine (CID 58794270) is N-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine.
What is the SMILES notation for N-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine?
The canonical SMILES for N-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine is ON=C1CCCc2ccc(-c3ccccc3)cc21.
What is the InChIKey of N-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine?
The InChIKey is OVXZMHWFIDGVOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c18-17-16-8-4-7-13-9-10-14(11-15(13)16)12-5-2-1-3-6-12/h1-3,5-6,9-11,18H,4,7-8H2.
What are the key properties of N-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine?
N-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine has a molecular weight of 237.30 g/mol, XLogP of 3.87, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-phenyl-3,4-dihydro-2H-naphthalen-1-ylidene)hydroxylamine is sourced from PubChem (CID 58794270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).