4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide

C19H23NO3 — CID 86938124

IUPAC4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide
SMILESCCOc1ccc(C(=O)Nc2ccccc2OC(C)C)cc1C
InChIInChI=1S/C19H23NO3/c1-5-22-17-11-10-15(12-14(17)4)19(21)20-16-8-6-7-9-18(16)23-13(2)3/h6-13H,5H2,1-4H3,(H,20,21)
InChIKeyBXQCGUPKCALCRO-UHFFFAOYSA-N
MW313.40 g/mol
LogP4.43
Rot. Bonds6

About 4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide

4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide (PubChem CID 86938124) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide.

Molecular Properties

Compound Name4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide
PubChem CID86938124
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide
SMILESCCOc1ccc(C(=O)Nc2ccccc2OC(C)C)cc1C
InChIInChI=1S/C19H23NO3/c1-5-22-17-11-10-15(12-14(17)4)19(21)20-16-8-6-7-9-18(16)23-13(2)3/h6-13H,5H2,1-4H3,(H,20,21)
InChIKeyBXQCGUPKCALCRO-UHFFFAOYSA-N
XLogP4.43
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-4-ethoxy-N-(2-propan-2-yloxyphenyl)benzamide
CID 17151006
2-[2-ethoxy-4-[(2-propan-2-yloxyphenyl)carbamoyl]phenoxy]acetic acid
CID 119180523
3-bromo-N-(2-ethoxyphenyl)-4-propan-2-yloxybenzamide
CID 17355255
N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide
CID 95970601
3-bromo-4-propan-2-yloxy-N-(2-propan-2-yloxyphenyl)benzamide
CID 17150992
3,4-diethoxy-N-(2-methoxyphenyl)benzamide
CID 669527
3-methyl-N-(2-propan-2-yloxyphenyl)benzamide
CID 17150877
3-chloro-N-[2-(difluoromethoxy)phenyl]-4-ethoxybenzamide
CID 1256588
5-(2-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109245416
N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
CID 109245387
3-bromo-4-methoxy-N-(2-propan-2-yloxyphenyl)benzamide
CID 17150898
1-N-phenyl-4-N-(2-propan-2-yloxyphenyl)benzene-1,4-dicarboxamide
CID 109049242

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide?
The IUPAC name of 4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide (CID 86938124) is 4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide.
What is the SMILES notation for 4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide?
The canonical SMILES for 4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide is CCOc1ccc(C(=O)Nc2ccccc2OC(C)C)cc1C.
What is the InChIKey of 4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide?
The InChIKey is BXQCGUPKCALCRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-5-22-17-11-10-15(12-14(17)4)19(21)20-16-8-6-7-9-18(16)23-13(2)3/h6-13H,5H2,1-4H3,(H,20,21).
What are the key properties of 4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide?
4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide has a molecular weight of 313.40 g/mol, XLogP of 4.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide is sourced from PubChem (CID 86938124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).