2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide

C19H23NO3 — CID 844817

IUPAC2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
SMILESCOc1ccc(C(=O)Nc2c(C)cccc2C(C)C)c(OC)c1
InChIInChI=1S/C19H23NO3/c1-12(2)15-8-6-7-13(3)18(15)20-19(21)16-10-9-14(22-4)11-17(16)23-5/h6-12H,1-5H3,(H,20,21)
InChIKeyNTLUEZJJRQKRTI-UHFFFAOYSA-N
MW313.40 g/mol
LogP4.39
Rot. Bonds5

About 2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide

2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide (PubChem CID 844817) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound Name2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
PubChem CID844817
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
SMILESCOc1ccc(C(=O)Nc2c(C)cccc2C(C)C)c(OC)c1
InChIInChI=1S/C19H23NO3/c1-12(2)15-8-6-7-13(3)18(15)20-19(21)16-10-9-14(22-4)11-17(16)23-5/h6-12H,1-5H3,(H,20,21)
InChIKeyNTLUEZJJRQKRTI-UHFFFAOYSA-N
XLogP4.39
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-dimethoxyphenyl)-N'-(2-methyl-6-propan-2-ylphenyl)propanediamide
CID 108954579
1-acetyl-5-methoxy-N-(2-methyl-6-propan-2-ylphenyl)indole-3-carboxamide
CID 113212789
2-ethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 4106952
2-methoxy-N-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl]benzamide
CID 112997388
3-(N-acetyl-2,4-dimethoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 113130141
2-(3-methoxyphenoxy)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 19203579
[(2R)-1-(2-methyl-6-propan-2-ylanilino)-1-oxopropan-2-yl] 2,4,5-trimethoxybenzoate
CID 9440533
2-(4-methoxyphenoxy)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 7688543
2,4-dimethoxy-N-(3-methyl-2-pyridinyl)benzamide
CID 5163949
2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide
CID 793888
4-(difluoromethoxy)-3-methoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide
CID 7919835
2-(3-methoxyphenoxy)-N-(2-methyl-6-propan-2-ylphenyl)butanamide
CID 132761053

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide?
The IUPAC name of 2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide (CID 844817) is 2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide.
What is the SMILES notation for 2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide?
The canonical SMILES for 2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide is COc1ccc(C(=O)Nc2c(C)cccc2C(C)C)c(OC)c1.
What is the InChIKey of 2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide?
The InChIKey is NTLUEZJJRQKRTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-12(2)15-8-6-7-13(3)18(15)20-19(21)16-10-9-14(22-4)11-17(16)23-5/h6-12H,1-5H3,(H,20,21).
What are the key properties of 2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide?
2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide has a molecular weight of 313.40 g/mol, XLogP of 4.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-N-(2-methyl-6-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 844817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).