3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide

C18H21NO3 — CID 6457881

IUPAC3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide
SMILESCOc1cc(C(=O)Nc2ccc(C)cc2)ccc1OC(C)C
InChIInChI=1S/C18H21NO3/c1-12(2)22-16-10-7-14(11-17(16)21-4)18(20)19-15-8-5-13(3)6-9-15/h5-12H,1-4H3,(H,19,20)
InChIKeyDZZKJJXPZCHTEC-UHFFFAOYSA-N
MW299.37 g/mol
LogP4.04
Rot. Bonds5

About 3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide

3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide (PubChem CID 6457881) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is 3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide.

Molecular Properties

Compound Name3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide
PubChem CID6457881
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide
SMILESCOc1cc(C(=O)Nc2ccc(C)cc2)ccc1OC(C)C
InChIInChI=1S/C18H21NO3/c1-12(2)22-16-10-7-14(11-17(16)21-4)18(20)19-15-8-5-13(3)6-9-15/h5-12H,1-4H3,(H,19,20)
InChIKeyDZZKJJXPZCHTEC-UHFFFAOYSA-N
XLogP4.04
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide 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

N-(3,4-dichlorophenyl)-3-methoxy-4-propan-2-yloxybenzamide
CID 2223889
N-(3,4-difluorophenyl)-3-methoxy-4-propan-2-yloxybenzamide
CID 51159004
3-methoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 9071746
3-methoxy-N'-[2-(4-methylanilino)acetyl]-4-propan-2-yloxybenzohydrazide
CID 55348617
ethane;4-methoxy-3-methyl-N-(4-methylphenyl)benzamide
CID 54213440
N-[4-(difluoromethoxy)-3-methoxyphenyl]-4-methylbenzamide
CID 4865288
3,4,5-trimethoxy-N-(3-methoxy-4-propan-2-yloxyphenyl)benzamide
CID 26435232
3-methoxy-N-(4-methyl-3-sulfamoylphenyl)-4-propan-2-yloxybenzamide
CID 46520822
3-chloro-4-methoxy-N-(4-methylphenyl)benzamide
CID 2976183
3-methoxy-N-(4-methylphenyl)-4-prop-2-enoxybenzamide
CID 27284512
3,5-dimethoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 2092676
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methoxy-4-propan-2-yloxybenzamide
CID 2980923

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide?
The IUPAC name of 3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide (CID 6457881) is 3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide.
What is the SMILES notation for 3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide?
The canonical SMILES for 3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide is COc1cc(C(=O)Nc2ccc(C)cc2)ccc1OC(C)C.
What is the InChIKey of 3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide?
The InChIKey is DZZKJJXPZCHTEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-12(2)22-16-10-7-14(11-17(16)21-4)18(20)19-15-8-5-13(3)6-9-15/h5-12H,1-4H3,(H,19,20).
What are the key properties of 3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide?
3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide has a molecular weight of 299.37 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(4-methylphenyl)-4-propan-2-yloxybenzamide is sourced from PubChem (CID 6457881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).