N-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide

C20H18N2O2 — CID 2892734

IUPACN-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide
SMILESCc1cccc(NC(=O)c2cccc(OCc3ccccc3)c2)n1
InChIInChI=1S/C20H18N2O2/c1-15-7-5-12-19(21-15)22-20(23)17-10-6-11-18(13-17)24-14-16-8-3-2-4-9-16/h2-13H,14H2,1H3,(H,21,22,23)
InChIKeyVLIHGYIODFUDOC-UHFFFAOYSA-N
MW318.38 g/mol
LogP4.22
Rot. Bonds5

About N-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide

N-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide (PubChem CID 2892734) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide
PubChem CID2892734
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC NameN-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide
SMILESCc1cccc(NC(=O)c2cccc(OCc3ccccc3)c2)n1
InChIInChI=1S/C20H18N2O2/c1-15-7-5-12-19(21-15)22-20(23)17-10-6-11-18(13-17)24-14-16-8-3-2-4-9-16/h2-13H,14H2,1H3,(H,21,22,23)
InChIKeyVLIHGYIODFUDOC-UHFFFAOYSA-N
XLogP4.22
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide?
The IUPAC name of N-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide (CID 2892734) is N-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide is Cc1cccc(NC(=O)c2cccc(OCc3ccccc3)c2)n1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide?
The InChIKey is VLIHGYIODFUDOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c1-15-7-5-12-19(21-15)22-20(23)17-10-6-11-18(13-17)24-14-16-8-3-2-4-9-16/h2-13H,14H2,1H3,(H,21,22,23).
What are the key properties of N-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide?
N-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide has a molecular weight of 318.38 g/mol, XLogP of 4.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-3-phenylmethoxybenzamide is sourced from PubChem (CID 2892734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).