3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide

C19H22N2O3 — CID 46756320

IUPAC3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide
SMILESCOc1cccc(C(=O)NCC(=O)Nc2ccccc2C(C)C)c1
InChIInChI=1S/C19H22N2O3/c1-13(2)16-9-4-5-10-17(16)21-18(22)12-20-19(23)14-7-6-8-15(11-14)24-3/h4-11,13H,12H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyGZPVFZHEHZGIEB-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.19
Rot. Bonds6

About 3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide

3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide (PubChem CID 46756320) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide
PubChem CID46756320
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide
SMILESCOc1cccc(C(=O)NCC(=O)Nc2ccccc2C(C)C)c1
InChIInChI=1S/C19H22N2O3/c1-13(2)16-9-4-5-10-17(16)21-18(22)12-20-19(23)14-7-6-8-15(11-14)24-3/h4-11,13H,12H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyGZPVFZHEHZGIEB-UHFFFAOYSA-N
XLogP3.19
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide
CID 46755792
N-[2-(2-tert-butylanilino)-2-oxoethyl]-3-methoxybenzamide
CID 112997486
[2-[2-[(2R)-butan-2-yl]anilino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate
CID 7882709
3-methoxy-N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]benzamide
CID 112999073
3-ethoxy-N-(2-propan-2-ylphenyl)benzamide
CID 799138
N-[2-(1-chloroethyl)phenyl]-3-methoxybenzamide
CID 114304807
2-(2,4-dimethoxyanilino)-N-(2-propan-2-ylphenyl)acetamide
CID 37479068
3-methoxy-N-[2-[1-(methylamino)ethyl]phenyl]benzamide
CID 43507956
methyl 4-[[2-[(3-methoxybenzoyl)amino]acetyl]amino]benzoate
CID 26583191
N-[2-(3-methoxyanilino)-2-oxoethyl]-3-methylbenzamide
CID 4679398
N-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-3-methylbenzamide
CID 3503389
N-[2-(3,5-dichloroanilino)-2-oxoethyl]-3-methoxybenzamide
CID 46745605

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide?
The IUPAC name of 3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide (CID 46756320) is 3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide.
What is the SMILES notation for 3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide?
The canonical SMILES for 3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide is COc1cccc(C(=O)NCC(=O)Nc2ccccc2C(C)C)c1.
What is the InChIKey of 3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide?
The InChIKey is GZPVFZHEHZGIEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-13(2)16-9-4-5-10-17(16)21-18(22)12-20-19(23)14-7-6-8-15(11-14)24-3/h4-11,13H,12H2,1-3H3,(H,20,23)(H,21,22).
What are the key properties of 3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide?
3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide has a molecular weight of 326.40 g/mol, XLogP of 3.19, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[2-oxo-2-(2-propan-2-ylanilino)ethyl]benzamide is sourced from PubChem (CID 46756320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).