4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide

C19H19N3O3 — CID 2495025

IUPAC4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide
SMILESCc1noc(C)c1COc1ccc(C(=O)NCc2ccccn2)cc1
InChIInChI=1S/C19H19N3O3/c1-13-18(14(2)25-22-13)12-24-17-8-6-15(7-9-17)19(23)21-11-16-5-3-4-10-20-16/h3-10H,11-12H2,1-2H3,(H,21,23)
InChIKeyMFVSGCDPMIOOIT-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.20
Rot. Bonds6

About 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide

4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 2495025) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide
PubChem CID2495025
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide
SMILESCc1noc(C)c1COc1ccc(C(=O)NCc2ccccn2)cc1
InChIInChI=1S/C19H19N3O3/c1-13-18(14(2)25-22-13)12-24-17-8-6-15(7-9-17)19(23)21-11-16-5-3-4-10-20-16/h3-10H,11-12H2,1-2H3,(H,21,23)
InChIKeyMFVSGCDPMIOOIT-UHFFFAOYSA-N
XLogP3.20
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide (CID 2495025) is 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide is Cc1noc(C)c1COc1ccc(C(=O)NCc2ccccn2)cc1.
What is the InChIKey of 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is MFVSGCDPMIOOIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-13-18(14(2)25-22-13)12-24-17-8-6-15(7-9-17)19(23)21-11-16-5-3-4-10-20-16/h3-10H,11-12H2,1-2H3,(H,21,23).
What are the key properties of 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide?
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 337.38 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 2495025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).