N-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide

C19H23NO3 — CID 119046619

IUPACN-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(C)ccc2C)c(OC(C)C)c1
InChIInChI=1S/C19H23NO3/c1-12(2)23-18-11-15(22-5)8-9-16(18)19(21)20-17-10-13(3)6-7-14(17)4/h6-12H,1-5H3,(H,20,21)
InChIKeyMCWLIXVNKKCMRK-UHFFFAOYSA-N
MW313.40 g/mol
LogP4.35
Rot. Bonds5

About N-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide

N-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide (PubChem CID 119046619) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide
PubChem CID119046619
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(C)ccc2C)c(OC(C)C)c1
InChIInChI=1S/C19H23NO3/c1-12(2)23-18-11-15(22-5)8-9-16(18)19(21)20-17-10-13(3)6-7-14(17)4/h6-12H,1-5H3,(H,20,21)
InChIKeyMCWLIXVNKKCMRK-UHFFFAOYSA-N
XLogP4.35
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 ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[(4-methoxy-2-propan-2-yloxybenzoyl)amino]-3-methylphenoxy]acetic acid
CID 120687359
N-(2-fluoro-5-methylphenyl)-2,4-dimethoxybenzamide
CID 16546475
N-(2,5-dimethylphenyl)-2,4,5-trimethoxybenzamide
CID 2596685
(2R)-N-(2,5-dimethylphenyl)-2-(4-methoxyphenoxy)propanamide
CID 719385
3-bromo-N-(2,5-dimethylphenyl)-4-propan-2-yloxybenzamide
CID 17355192
2-chloro-N-(2,4-dimethoxyphenyl)-4-methylbenzamide
CID 885610
[4-[(2,5-dimethylphenyl)carbamoyl]phenyl] 2-(2,5-dimethylphenoxy)propanoate
CID 53266948
[2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl] 2,4-dimethoxybenzoate
CID 42963212
2-N-(2,4-dimethoxyphenyl)-1-N-(2,5-dimethylphenyl)cyclopropane-1,2-dicarboxamide
CID 109141613
N-(2,5-dimethylphenyl)-2,6-dimethoxybenzamide
CID 2842934
N-(2,5-dimethylphenyl)-4-oxo-4-[2-(2-propan-2-yloxybenzoyl)hydrazinyl]butanamide
CID 17045660
2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 110761096

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide?
The IUPAC name of N-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide (CID 119046619) is N-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide is COc1ccc(C(=O)Nc2cc(C)ccc2C)c(OC(C)C)c1.
What is the InChIKey of N-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide?
The InChIKey is MCWLIXVNKKCMRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-12(2)23-18-11-15(22-5)8-9-16(18)19(21)20-17-10-13(3)6-7-14(17)4/h6-12H,1-5H3,(H,20,21).
What are the key properties of N-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide?
N-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide has a molecular weight of 313.40 g/mol, XLogP of 4.35, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-4-methoxy-2-propan-2-yloxybenzamide is sourced from PubChem (CID 119046619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).