N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine

C25H20ClNO — CID 126217896

IUPACN-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine
SMILESCc1ccc(Cl)cc1/N=C\c1ccccc1OCc1cccc2ccccc12
InChIInChI=1S/C25H20ClNO/c1-18-13-14-22(26)15-24(18)27-16-20-8-3-5-12-25(20)28-17-21-10-6-9-19-7-2-4-11-23(19)21/h2-16H,17H2,1H3/b27-16-
InChIKeyNURSSCDOFKKVKF-YUMHPJSZSA-N
MW385.89 g/mol
LogP7.13
Rot. Bonds5

About N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine

N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine (PubChem CID 126217896) has the molecular formula C25H20ClNO and a molecular weight of 385.89 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine
PubChem CID126217896
Molecular FormulaC25H20ClNO
Molecular Weight385.89 g/mol
Exact Mass385.12
IUPAC NameN-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine
SMILESCc1ccc(Cl)cc1/N=C\c1ccccc1OCc1cccc2ccccc12
InChIInChI=1S/C25H20ClNO/c1-18-13-14-22(26)15-24(18)27-16-20-8-3-5-12-25(20)28-17-21-10-6-9-19-7-2-4-11-23(19)21/h2-16H,17H2,1H3/b27-16-
InChIKeyNURSSCDOFKKVKF-YUMHPJSZSA-N
XLogP7.13
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.89
LogP ≤ 57.13
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-(5-chloro-2-methylphenyl)-1-[3-iodo-5-methoxy-4-(naphthalen-1-ylmethoxy)phenyl]methanimine
CID 126219624
1-[5-bromo-2-[(2,4-dichlorophenyl)methoxy]phenyl]-N-(5-chloro-2-methylphenyl)methanimine
CID 126217471
1-[5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl]-N-(2-methylphenyl)methanimine
CID 126225144
N-(5-chloro-2-methylphenyl)-1-(2-chlorophenyl)methanimine
CID 4191286
N-naphthalen-1-yl-1-(2-phenylmethoxyphenyl)methanimine
CID 4644937
N-(2,3-dimethylphenyl)-1-[2-[(2-fluorophenyl)methoxy]phenyl]methanimine
CID 126221634
N-[(Z)-[5-chloro-2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]-2-(2,4-dimethylphenyl)acetamide
CID 92657836
N-(5-chloro-2-methylphenyl)-1-[4-[(2-chlorophenyl)methoxy]phenyl]methanimine
CID 126206758
N-(5-chloro-2-methylphenyl)-1-[3-[(2-fluorophenyl)methoxy]phenyl]methanimine
CID 126219727
N-(3-chloro-2-methylphenyl)-1-[3-chloro-4-(naphthalen-1-ylmethoxy)phenyl]methanimine
CID 126217246
4-[[2-[(5-chloro-2-methylphenyl)iminomethyl]-6-methoxyphenoxy]methyl]benzoic acid
CID 126193499
3-methyl-N-[(E)-[2-(naphthalen-1-ylmethoxy)phenyl]methylideneamino]benzamide
CID 96892720

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine?
The IUPAC name of N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine (CID 126217896) is N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine is Cc1ccc(Cl)cc1/N=C\c1ccccc1OCc1cccc2ccccc12.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine?
The InChIKey is NURSSCDOFKKVKF-YUMHPJSZSA-N. The full InChI is InChI=1S/C25H20ClNO/c1-18-13-14-22(26)15-24(18)27-16-20-8-3-5-12-25(20)28-17-21-10-6-9-19-7-2-4-11-23(19)21/h2-16H,17H2,1H3/b27-16-.
What are the key properties of N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine?
N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine has a molecular weight of 385.89 g/mol, XLogP of 7.13, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-1-[2-(naphthalen-1-ylmethoxy)phenyl]methanimine is sourced from PubChem (CID 126217896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).