3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide

C19H20N2O4 — CID 46424516

IUPAC3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2ccc3oc(C(C)C)nc3c2)c1
InChIInChI=1S/C19H20N2O4/c1-11(2)19-21-16-9-13(5-6-17(16)25-19)20-18(22)12-7-14(23-3)10-15(8-12)24-4/h5-11H,1-4H3,(H,20,22)
InChIKeyQMWDHPBUXCQDMT-UHFFFAOYSA-N
MW340.38 g/mol
LogP4.22
Rot. Bonds5

About 3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide

3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide (PubChem CID 46424516) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is 3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide
PubChem CID46424516
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC Name3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2ccc3oc(C(C)C)nc3c2)c1
InChIInChI=1S/C19H20N2O4/c1-11(2)19-21-16-9-13(5-6-17(16)25-19)20-18(22)12-7-14(23-3)10-15(8-12)24-4/h5-11H,1-4H3,(H,20,22)
InChIKeyQMWDHPBUXCQDMT-UHFFFAOYSA-N
XLogP4.22
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,5-dimethoxy-N-[3-methyl-1-oxo-1-[(2-propan-2-yl-1,3-benzoxazol-5-yl)amino]butan-2-yl]benzamide
CID 55620274
3,5-dimethoxy-N-[2-(4-propan-2-ylphenyl)-1,3-benzoxazol-5-yl]benzamide
CID 17127524
4-[(4-methoxyphenyl)sulfamoyl]-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide
CID 46401839
N-(4-methoxyphenyl)-2-propan-2-yl-1,3-benzoxazole-6-carboxamide
CID 53089495
3-acetamido-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide
CID 46401870
N-(3-methoxyphenyl)-2-propan-2-yl-1,3-benzoxazole-6-carboxamide
CID 53089494
N-[2-(2-fluorophenyl)-1,3-benzoxazol-5-yl]-3,5-dimethoxybenzamide
CID 1015782
4-[(2-methylcyclopropanecarbonyl)amino]-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide
CID 46460476
N-(2-propan-2-yl-1,3-benzoxazol-5-yl)-4-(tetrazol-1-yl)benzamide
CID 47026774
4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide
CID 46416378
5-bromo-3-methyl-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)furan-2-carboxamide
CID 60509237
5-(2-methoxyphenyl)-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)-1,2-oxazole-3-carboxamide
CID 47028094

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide?
The IUPAC name of 3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide (CID 46424516) is 3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide?
The canonical SMILES for 3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide is COc1cc(OC)cc(C(=O)Nc2ccc3oc(C(C)C)nc3c2)c1.
What is the InChIKey of 3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide?
The InChIKey is QMWDHPBUXCQDMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-11(2)19-21-16-9-13(5-6-17(16)25-19)20-18(22)12-7-14(23-3)10-15(8-12)24-4/h5-11H,1-4H3,(H,20,22).
What are the key properties of 3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide?
3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide has a molecular weight of 340.38 g/mol, XLogP of 4.22, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)benzamide is sourced from PubChem (CID 46424516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).