N-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine

C15H14ClNO — CID 780574

IUPACN-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine
SMILESCOc1ccc(/C=N/c2cccc(Cl)c2C)cc1
InChIInChI=1S/C15H14ClNO/c1-11-14(16)4-3-5-15(11)17-10-12-6-8-13(18-2)9-7-12/h3-10H,1-2H3/b17-10+
InChIKeyVZXYUKHHAOELFM-LICLKQGHSA-N
MW259.74 g/mol
LogP4.41
Rot. Bonds3

About N-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine

N-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine (PubChem CID 780574) has the molecular formula C15H14ClNO and a molecular weight of 259.74 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine
PubChem CID780574
Molecular FormulaC15H14ClNO
Molecular Weight259.74 g/mol
Exact Mass259.08
IUPAC NameN-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine
SMILESCOc1ccc(/C=N/c2cccc(Cl)c2C)cc1
InChIInChI=1S/C15H14ClNO/c1-11-14(16)4-3-5-15(11)17-10-12-6-8-13(18-2)9-7-12/h3-10H,1-2H3/b17-10+
InChIKeyVZXYUKHHAOELFM-LICLKQGHSA-N
XLogP4.41
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.74
LogP ≤ 54.41
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-(3-chloro-2-methylphenyl)-1-[4-(4-chlorophenyl)sulfanylphenyl]methanimine
CID 126103481
1-(4-methoxyphenyl)-N-[2-[2-[2-[(4-methoxyphenyl)methylideneamino]phenyl]ethyl]phenyl]methanimine
CID 71317432
2-[4-[(3-chloro-2-methylphenyl)iminomethyl]phenoxy]-1-morpholin-4-ylethanone
CID 126253048
N-(3-chloro-2-methylphenyl)-1-(4-chloro-3-nitrophenyl)methanimine
CID 693294
1-(4-methoxyphenyl)-N-[3-[(4-methoxyphenyl)methylideneamino]phenyl]methanimine
CID 18527961
N-(3-chloro-2-methylphenyl)-N'-[(4-methoxyphenyl)methylideneamino]butanediamide
CID 4537562
2-[3-[(3-chloro-2-methylphenyl)iminomethyl]phenoxy]acetic acid
CID 126224697
N-(3,4-dichlorophenyl)-1-(4-methoxyphenyl)methanimine
CID 958548
N-(3-chloro-2-methylphenyl)-1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]methanimine
CID 126217246
N'-(3-chloro-2-methylphenyl)-N,N-dimethylmethanimidamide
CID 25765
1-(2,6-dichlorophenyl)-N-(4-methoxyphenyl)methanimine
CID 927293
N-(2,5-dimethoxyphenyl)-1-(4-methoxyphenyl)methanimine
CID 5201061

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine?
The IUPAC name of N-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine (CID 780574) is N-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine is COc1ccc(/C=N/c2cccc(Cl)c2C)cc1.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine?
The InChIKey is VZXYUKHHAOELFM-LICLKQGHSA-N. The full InChI is InChI=1S/C15H14ClNO/c1-11-14(16)4-3-5-15(11)17-10-12-6-8-13(18-2)9-7-12/h3-10H,1-2H3/b17-10+.
What are the key properties of N-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine?
N-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine has a molecular weight of 259.74 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-1-(4-methoxyphenyl)methanimine is sourced from PubChem (CID 780574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).