N-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine

C16H16ClNO — CID 22483144

IUPACN-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine
SMILESCOc1ccccc1/C=N/C(C)c1ccccc1Cl
InChIInChI=1S/C16H16ClNO/c1-12(14-8-4-5-9-15(14)17)18-11-13-7-3-6-10-16(13)19-2/h3-12H,1-2H3/b18-11+
InChIKeyQRNHMHCPVZPABY-WOJGMQOQSA-N
MW273.76 g/mol
LogP4.53
Rot. Bonds4

About N-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine

N-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine (PubChem CID 22483144) has the molecular formula C16H16ClNO and a molecular weight of 273.76 g/mol. Its IUPAC name is N-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine.

Molecular Properties

Compound NameN-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine
PubChem CID22483144
Molecular FormulaC16H16ClNO
Molecular Weight273.76 g/mol
Exact Mass273.09
IUPAC NameN-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine
SMILESCOc1ccccc1/C=N/C(C)c1ccccc1Cl
InChIInChI=1S/C16H16ClNO/c1-12(14-8-4-5-9-15(14)17)18-11-13-7-3-6-10-16(13)19-2/h3-12H,1-2H3/b18-11+
InChIKeyQRNHMHCPVZPABY-WOJGMQOQSA-N
XLogP4.53
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.76
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[1-(2,3-dichlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine
CID 22483399
1-(2-methoxyphenyl)-N-[1-(2,4,6-trichlorophenyl)ethyl]methanimine
CID 22483125
1-(2-methoxyphenyl)-N-[(1R)-1-naphthalen-1-ylethyl]methanimine
CID 10637187
N-[1-(2,3-dichlorophenyl)ethyl]-1-(2-ethoxyphenyl)methanimine
CID 22483121
N-[1-(2-chlorophenyl)ethyl]-1-(4-methylphenyl)methanimine
CID 22483225
N-[1-(2-chlorophenyl)ethyl]-1-(2,4,6-trimethylphenyl)methanimine
CID 22483401
N-[1-(2-chlorophenyl)ethyl]-1-(4-phenylphenyl)methanimine
CID 22483010
1-(2-phenoxyphenyl)-N-[1-(2,4,6-trichlorophenyl)ethyl]methanimine
CID 22483201
cobalt;2-[[(1S,2R)-2-[(2-hydroxyphenyl)methylideneamino]-1,2-bis(2-methoxyphenyl)ethyl]iminomethyl]phenol
CID 135440453
methyl (2S)-2-[(2-methoxyphenyl)methylideneamino]-3-methylbutanoate
CID 11482060
lithium [(E)-(2-methoxyphenyl)methylideneamino]-methyl-bis(2-methylpropyl)alumanuide
CID 134997042
1-chloro-2-methoxybenzene
CID 13011

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine?
The IUPAC name of N-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine (CID 22483144) is N-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine.
What is the SMILES notation for N-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine?
The canonical SMILES for N-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine is COc1ccccc1/C=N/C(C)c1ccccc1Cl.
What is the InChIKey of N-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine?
The InChIKey is QRNHMHCPVZPABY-WOJGMQOQSA-N. The full InChI is InChI=1S/C16H16ClNO/c1-12(14-8-4-5-9-15(14)17)18-11-13-7-3-6-10-16(13)19-2/h3-12H,1-2H3/b18-11+.
What are the key properties of N-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine?
N-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine has a molecular weight of 273.76 g/mol, XLogP of 4.53, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-chlorophenyl)ethyl]-1-(2-methoxyphenyl)methanimine is sourced from PubChem (CID 22483144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).