1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine

C22H20NO2P — CID 123655225

IUPAC1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine
SMILESC=Pc1cccc(/N=C/c2ccccc2OC)c1OCc1ccccc1
InChIInChI=1S/C22H20NO2P/c1-24-20-13-7-6-11-18(20)15-23-19-12-8-14-21(26-2)22(19)25-16-17-9-4-3-5-10-17/h3-15H,2,16H2,1H3/b23-15+
InChIKeyKAPANIKSOKEIGB-HZHRSRAPSA-N
MW361.38 g/mol
LogP5.03
Rot. Bonds7

About 1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine

1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine (PubChem CID 123655225) has the molecular formula C22H20NO2P and a molecular weight of 361.38 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine
PubChem CID123655225
Molecular FormulaC22H20NO2P
Molecular Weight361.38 g/mol
Exact Mass361.12
IUPAC Name1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine
SMILESC=Pc1cccc(/N=C/c2ccccc2OC)c1OCc1ccccc1
InChIInChI=1S/C22H20NO2P/c1-24-20-13-7-6-11-18(20)15-23-19-12-8-14-21(26-2)22(19)25-16-17-9-4-3-5-10-17/h3-15H,2,16H2,1H3/b23-15+
InChIKeyKAPANIKSOKEIGB-HZHRSRAPSA-N
XLogP5.03
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.38
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine
CID 4644937
1-(2-methoxyphenyl)-N-phenylmethoxymethanimine
CID 75981021
4-[[2-methoxy-6-[(2-methoxycarbonylphenyl)iminomethyl]phenoxy]methyl]benzoic acid
CID 126192850
potassium;3-methoxy-2-phenylmethoxybenzaldehyde;hydroxide
CID 160863194
1-ethenyl-2-methoxy-3-phenylmethoxybenzene
CID 23251754
3-[[2-[(4-carboxyphenyl)methoxy]-3-methoxyphenyl]methylideneamino]-4-chlorobenzoic acid
CID 126193417
1-(2-methoxyphenyl)-N-[1-[2-[(2-methoxyphenyl)methylideneamino]naphthalen-1-yl]naphthalen-2-yl]methanimine
CID 11519235
(2-phenylmethoxyphenyl)methylidenehydrazine
CID 78678885
4-[[2-[(4-carboxyphenyl)iminomethyl]-6-methoxyphenoxy]methyl]benzoic acid
CID 126193715
4-[[2-methoxy-6-[(3-methoxycarbonyl-2-methylphenyl)iminomethyl]phenoxy]methyl]benzoic acid
CID 126194604
1-(3-chloro-5-methoxy-4-phenylmethoxyphenyl)-N-(2,3-dimethylphenyl)methanimine
CID 126222406
1-tert-butyl-3-[(3-methoxy-2-phenylmethoxyphenyl)methylideneamino]thiourea
CID 2798118

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine?
The IUPAC name of 1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine (CID 123655225) is 1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine?
The canonical SMILES for 1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine is C=Pc1cccc(/N=C/c2ccccc2OC)c1OCc1ccccc1.
What is the InChIKey of 1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine?
The InChIKey is KAPANIKSOKEIGB-HZHRSRAPSA-N. The full InChI is InChI=1S/C22H20NO2P/c1-24-20-13-7-6-11-18(20)15-23-19-12-8-14-21(26-2)22(19)25-16-17-9-4-3-5-10-17/h3-15H,2,16H2,1H3/b23-15+.
What are the key properties of 1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine?
1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine has a molecular weight of 361.38 g/mol, XLogP of 5.03, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N-(3-methylidenephosphanyl-2-phenylmethoxyphenyl)methanimine is sourced from PubChem (CID 123655225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).