4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide

C22H18N2O4 — CID 3511724

IUPAC4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccc3oc(-c4ccc(OC)cc4)nc3c2)cc1
InChIInChI=1S/C22H18N2O4/c1-26-17-8-3-14(4-9-17)21(25)23-16-7-12-20-19(13-16)24-22(28-20)15-5-10-18(27-2)11-6-15/h3-13H,1-2H3,(H,23,25)
InChIKeyAZGZJIGRQLPADH-UHFFFAOYSA-N
MW374.40 g/mol
LogP4.76
Rot. Bonds5

About 4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide

4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide (PubChem CID 3511724) has the molecular formula C22H18N2O4 and a molecular weight of 374.40 g/mol. Its IUPAC name is 4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide
PubChem CID3511724
Molecular FormulaC22H18N2O4
Molecular Weight374.40 g/mol
Exact Mass374.13
IUPAC Name4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccc3oc(-c4ccc(OC)cc4)nc3c2)cc1
InChIInChI=1S/C22H18N2O4/c1-26-17-8-3-14(4-9-17)21(25)23-16-7-12-20-19(13-16)24-22(28-20)15-5-10-18(27-2)11-6-15/h3-13H,1-2H3,(H,23,25)
InChIKeyAZGZJIGRQLPADH-UHFFFAOYSA-N
XLogP4.76
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide?
The IUPAC name of 4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide (CID 3511724) is 4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide.
What is the SMILES notation for 4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide?
The canonical SMILES for 4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide is COc1ccc(C(=O)Nc2ccc3oc(-c4ccc(OC)cc4)nc3c2)cc1.
What is the InChIKey of 4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide?
The InChIKey is AZGZJIGRQLPADH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O4/c1-26-17-8-3-14(4-9-17)21(25)23-16-7-12-20-19(13-16)24-22(28-20)15-5-10-18(27-2)11-6-15/h3-13H,1-2H3,(H,23,25).
What are the key properties of 4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide?
4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide has a molecular weight of 374.40 g/mol, XLogP of 4.76, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]benzamide is sourced from PubChem (CID 3511724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).