(E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine

C24H20NOP — CID 12937091

IUPAC(E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine
SMILESC/C(=N\P(=O)(c1ccccc1)c1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C24H20NOP/c1-19(21-17-16-20-10-8-9-11-22(20)18-21)25-27(26,23-12-4-2-5-13-23)24-14-6-3-7-15-24/h2-18H,1H3/b25-19+
InChIKeyMSCNVWHWWDIUQT-NCELDCMTSA-N
MW369.40 g/mol
LogP5.58
Rot. Bonds4

About (E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine

(E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine (PubChem CID 12937091) has the molecular formula C24H20NOP and a molecular weight of 369.40 g/mol. Its IUPAC name is (E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine.

Molecular Properties

Compound Name(E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine
PubChem CID12937091
Molecular FormulaC24H20NOP
Molecular Weight369.40 g/mol
Exact Mass369.13
IUPAC Name(E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine
SMILESC/C(=N\P(=O)(c1ccccc1)c1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C24H20NOP/c1-19(21-17-16-20-10-8-9-11-22(20)18-21)25-27(26,23-12-4-2-5-13-23)24-14-6-3-7-15-24/h2-18H,1H3/b25-19+
InChIKeyMSCNVWHWWDIUQT-NCELDCMTSA-N
XLogP5.58
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.40
LogP ≤ 55.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(4-Methyl-1-naphthyl)(2-(1-naphthylmethyl)phenyl)methanimine
CID 418281
(NZ)-N-(1-phenanthren-3-ylethylidene)hydroxylamine
CID 5354493
(2-Methylphenyl)-[2-(naphthalen-1-ylmethyl)phenyl]methanimine;hydrochloride
CID 24190000
(2-Methylphenyl)(2-(1-naphthylmethyl)phenyl)methanimine
CID 418275
(2-Benzylphenyl)(2-naphthyl)methanimine
CID 418273
(3,5-Dimethylphenyl)(2-(1-naphthylmethyl)phenyl)methanimine
CID 418280
(NE)-N-(1-phenanthren-3-ylethylidene)hydroxylamine
CID 9561058
2-Acetylphenanthrene oxime
CID 9562560
(3,5-Dimethylphenyl)-[2-(naphthalen-1-ylmethyl)phenyl]methanimine;hydrochloride
CID 5351940
(4-Methylnaphthalen-1-yl)-[2-(naphthalen-1-ylmethyl)phenyl]methanimine;hydrochloride
CID 5351941
(E)-1-Naphthalen-2-yl-N-[(E)-1-naphthalen-2-ylethylideneamino]ethanimine
CID 9582864
N-(diphenylphosphinyl)acetophenoneimine
CID 85073507

Frequently Asked Questions

What is the IUPAC name of (E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine?
The IUPAC name of (E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine (CID 12937091) is (E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine.
What is the SMILES notation for (E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine?
The canonical SMILES for (E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine is C/C(=N\P(=O)(c1ccccc1)c1ccccc1)c1ccc2ccccc2c1.
What is the InChIKey of (E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine?
The InChIKey is MSCNVWHWWDIUQT-NCELDCMTSA-N. The full InChI is InChI=1S/C24H20NOP/c1-19(21-17-16-20-10-8-9-11-22(20)18-21)25-27(26,23-12-4-2-5-13-23)24-14-6-3-7-15-24/h2-18H,1H3/b25-19+.
What are the key properties of (E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine?
(E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine has a molecular weight of 369.40 g/mol, XLogP of 5.58, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-diphenylphosphoryl-1-naphthalen-2-ylethanimine is sourced from PubChem (CID 12937091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).