N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide

C20H18N2O2 — CID 108732451

IUPACN-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide
SMILESCc1cccc(C(=O)N(Cc2ccccn2)c2ccccc2O)c1
InChIInChI=1S/C20H18N2O2/c1-15-7-6-8-16(13-15)20(24)22(14-17-9-4-5-12-21-17)18-10-2-3-11-19(18)23/h2-13,23H,14H2,1H3
InChIKeyJQHFAWDTSVJNNY-UHFFFAOYSA-N
MW318.38 g/mol
LogP3.94
Rot. Bonds4

About N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide

N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 108732451) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound NameN-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide
PubChem CID108732451
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC NameN-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide
SMILESCc1cccc(C(=O)N(Cc2ccccn2)c2ccccc2O)c1
InChIInChI=1S/C20H18N2O2/c1-15-7-6-8-16(13-15)20(24)22(14-17-9-4-5-12-21-17)18-10-2-3-11-19(18)23/h2-13,23H,14H2,1H3
InChIKeyJQHFAWDTSVJNNY-UHFFFAOYSA-N
XLogP3.94
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide (CID 108732451) is N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide is Cc1cccc(C(=O)N(Cc2ccccn2)c2ccccc2O)c1.
What is the InChIKey of N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is JQHFAWDTSVJNNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c1-15-7-6-8-16(13-15)20(24)22(14-17-9-4-5-12-21-17)18-10-2-3-11-19(18)23/h2-13,23H,14H2,1H3.
What are the key properties of N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide?
N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 318.38 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 108732451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).