2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol

C14H12ClNO2 — CID 135689629

IUPAC2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol
SMILESCc1cc(O)c(Cl)cc1/N=C/c1ccccc1O
InChIInChI=1S/C14H12ClNO2/c1-9-6-14(18)11(15)7-12(9)16-8-10-4-2-3-5-13(10)17/h2-8,17-18H,1H3/b16-8+
InChIKeyNAXLMTHJVIWMMW-LZYBPNLTSA-N
MW261.71 g/mol
LogP3.81
Rot. Bonds2

About 2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol

2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol (PubChem CID 135689629) has the molecular formula C14H12ClNO2 and a molecular weight of 261.71 g/mol. Its IUPAC name is 2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol.

Molecular Properties

Compound Name2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol
PubChem CID135689629
Molecular FormulaC14H12ClNO2
Molecular Weight261.71 g/mol
Exact Mass261.06
IUPAC Name2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol
SMILESCc1cc(O)c(Cl)cc1/N=C/c1ccccc1O
InChIInChI=1S/C14H12ClNO2/c1-9-6-14(18)11(15)7-12(9)16-8-10-4-2-3-5-13(10)17/h2-8,17-18H,1H3/b16-8+
InChIKeyNAXLMTHJVIWMMW-LZYBPNLTSA-N
XLogP3.81
TPSA52.82 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.71
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(2,3,4,5-tetrachlorophenyl)iminomethyl]phenol
CID 156787542
2-[[6-[(2-hydroxyphenyl)methylideneamino]-2,7-dimethylacridin-3-yl]iminomethyl]phenol
CID 136862105
2-[(4-iodo-2-methylphenyl)iminomethyl]phenol
CID 630747
2-[(4-chloro-3-methylphenyl)iminomethyl]phenol
CID 135657353
2-[(2-chloro-4-fluorophenyl)iminomethyl]phenol
CID 135595437
2-[[2-[(2-hydroxyphenyl)methylideneamino]phenyl]iminomethyl]phenol;vanadium;hydrate
CID 171376264
copper 2-[(2-hydroxyphenyl)iminomethyl]phenol
CID 135534570
zinc 2-[(2-hydroxyphenyl)iminomethyl]phenol
CID 135534569
chromium;bis(2-[[2-[(2-hydroxyphenyl)methylideneamino]phenyl]iminomethyl]phenol);hydrate
CID 139236258
N-(5-chloro-2-methylphenyl)-1-(2-chlorophenyl)methanimine
CID 4191286
2-[(2-methylphenyl)methylideneamino]phenol
CID 11009223
2-[(2-fluoro-5-methylphenyl)iminomethyl]phenol
CID 4857118

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol?
The IUPAC name of 2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol (CID 135689629) is 2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol.
What is the SMILES notation for 2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol?
The canonical SMILES for 2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol is Cc1cc(O)c(Cl)cc1/N=C/c1ccccc1O.
What is the InChIKey of 2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol?
The InChIKey is NAXLMTHJVIWMMW-LZYBPNLTSA-N. The full InChI is InChI=1S/C14H12ClNO2/c1-9-6-14(18)11(15)7-12(9)16-8-10-4-2-3-5-13(10)17/h2-8,17-18H,1H3/b16-8+.
What are the key properties of 2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol?
2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol has a molecular weight of 261.71 g/mol, XLogP of 3.81, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-[(2-hydroxyphenyl)methylideneamino]-5-methylphenol is sourced from PubChem (CID 135689629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).