N-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide

C16H16N2O2 — CID 715799

IUPACN-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide
SMILESCC(=NNC(=O)c1cccc(C)c1)c1ccccc1O
InChIInChI=1S/C16H16N2O2/c1-11-6-5-7-13(10-11)16(20)18-17-12(2)14-8-3-4-9-15(14)19/h3-10,19H,1-2H3,(H,18,20)
InChIKeyKZKQTDSCYPLZDE-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.85
Rot. Bonds3

About N-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide

N-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide (PubChem CID 715799) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide.

Molecular Properties

Compound NameN-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide
PubChem CID715799
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC NameN-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide
SMILESCC(=NNC(=O)c1cccc(C)c1)c1ccccc1O
InChIInChI=1S/C16H16N2O2/c1-11-6-5-7-13(10-11)16(20)18-17-12(2)14-8-3-4-9-15(14)19/h3-10,19H,1-2H3,(H,18,20)
InChIKeyKZKQTDSCYPLZDE-UHFFFAOYSA-N
XLogP2.85
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-N,3-N-bis[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzene-1,3-dicarboxamide
CID 135656933
2-hydroxy-N-[(E)-1-[3-[(3-methylbenzoyl)amino]phenyl]ethylideneamino]benzamide
CID 25237435
3-methyl-N-[(Z)-1-(4-phenylphenyl)ethylideneamino]benzamide
CID 6271545
2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135472588
3-chloro-N-[(E)-1-(3-methylphenyl)ethylideneamino]benzamide
CID 19685334
3-bromo-N-[1-(3-methylphenyl)ethylideneamino]benzamide
CID 3319660
4-bromo-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135643111
4-tert-butyl-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135445579
N-[(Z)-1-(2-hydroxyphenyl)ethylideneamino]pyridine-3-carboxamide
CID 135889728
N-[1-(furan-2-yl)ethylideneamino]-3-methylbenzamide
CID 910469
2-chloro-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135688203
N-[(Z)-1-(2-hydroxyphenyl)ethylideneamino]-2-methoxybenzamide
CID 144899093

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide?
The IUPAC name of N-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide (CID 715799) is N-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide.
What is the SMILES notation for N-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide?
The canonical SMILES for N-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide is CC(=NNC(=O)c1cccc(C)c1)c1ccccc1O.
What is the InChIKey of N-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide?
The InChIKey is KZKQTDSCYPLZDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-11-6-5-7-13(10-11)16(20)18-17-12(2)14-8-3-4-9-15(14)19/h3-10,19H,1-2H3,(H,18,20).
What are the key properties of N-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide?
N-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide has a molecular weight of 268.32 g/mol, XLogP of 2.85, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-hydroxyphenyl)ethylideneamino]-3-methylbenzamide is sourced from PubChem (CID 715799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).