3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide

C19H18N2O4 — CID 843415

IUPAC3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide
SMILESCOc1ccc(OCc2cccc(C(=O)Nc3cc(C)on3)c2)cc1
InChIInChI=1S/C19H18N2O4/c1-13-10-18(21-25-13)20-19(22)15-5-3-4-14(11-15)12-24-17-8-6-16(23-2)7-9-17/h3-11H,12H2,1-2H3,(H,20,21,22)
InChIKeyQQAVADRQQYEFOH-UHFFFAOYSA-N
MW338.36 g/mol
LogP3.82
Rot. Bonds6

About 3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide

3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide (PubChem CID 843415) has the molecular formula C19H18N2O4 and a molecular weight of 338.36 g/mol. Its IUPAC name is 3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide.

Molecular Properties

Compound Name3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide
PubChem CID843415
Molecular FormulaC19H18N2O4
Molecular Weight338.36 g/mol
Exact Mass338.13
IUPAC Name3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide
SMILESCOc1ccc(OCc2cccc(C(=O)Nc3cc(C)on3)c2)cc1
InChIInChI=1S/C19H18N2O4/c1-13-10-18(21-25-13)20-19(22)15-5-3-4-14(11-15)12-24-17-8-6-16(23-2)7-9-17/h3-11H,12H2,1-2H3,(H,20,21,22)
InChIKeyQQAVADRQQYEFOH-UHFFFAOYSA-N
XLogP3.82
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(cyclopentyloxy)-N-(3-isoxazolyl)benzamide
CID 1226000
N-(5-methyl-1,2-oxazol-3-yl)-3-(5-phenylfuran-2-yl)propanamide
CID 2988348
N-(5-methyl-3-isoxazolyl)-2-phenoxybenzamide
CID 652253
4-methoxy-N-(5-methyl-3-isoxazolyl)benzamide
CID 670263
4-ethoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 670712
3,4-diethoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 717559
Benzamide, N-(1,2-benzisoxazol-3-yl)-4-methoxy-
CID 8033444
3-[(4-bromophenoxy)methyl]-N-(5-methyl-3-isoxazolyl)benzamide
CID 1224550
N-(5-methyl-3-isoxazolyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 2055082
2,6-dibutoxy-N-(5-methyl-3-isoxazolyl)benzamide
CID 2214635
[2-[(5-Methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 4-pentoxybenzoate
CID 2477266
2-(4-methoxyphenyl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 2905682

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
The IUPAC name of 3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide (CID 843415) is 3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide.
What is the SMILES notation for 3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
The canonical SMILES for 3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide is COc1ccc(OCc2cccc(C(=O)Nc3cc(C)on3)c2)cc1.
What is the InChIKey of 3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
The InChIKey is QQAVADRQQYEFOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4/c1-13-10-18(21-25-13)20-19(22)15-5-3-4-14(11-15)12-24-17-8-6-16(23-2)7-9-17/h3-11H,12H2,1-2H3,(H,20,21,22).
What are the key properties of 3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide?
3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide has a molecular weight of 338.36 g/mol, XLogP of 3.82, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methoxyphenoxy)methyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide is sourced from PubChem (CID 843415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).