3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide

C20H24N2O3 — CID 35339665

IUPAC3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide
SMILESCCOc1ccccc1NC(=O)c1cccc(NC(=O)C(C)(C)C)c1
InChIInChI=1S/C20H24N2O3/c1-5-25-17-12-7-6-11-16(17)22-18(23)14-9-8-10-15(13-14)21-19(24)20(2,3)4/h6-13H,5H2,1-4H3,(H,21,24)(H,22,23)
InChIKeyLHYHMSKPWHMYRF-UHFFFAOYSA-N
MW340.42 g/mol
LogP4.32
Rot. Bonds5

About 3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide

3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide (PubChem CID 35339665) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide.

Molecular Properties

Compound Name3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide
PubChem CID35339665
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide
SMILESCCOc1ccccc1NC(=O)c1cccc(NC(=O)C(C)(C)C)c1
InChIInChI=1S/C20H24N2O3/c1-5-25-17-12-7-6-11-16(17)22-18(23)14-9-8-10-15(13-14)21-19(24)20(2,3)4/h6-13H,5H2,1-4H3,(H,21,24)(H,22,23)
InChIKeyLHYHMSKPWHMYRF-UHFFFAOYSA-N
XLogP4.32
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 7311959
N-(2-ethoxyphenyl)-3-[[4-(trifluoromethyl)benzoyl]amino]benzamide
CID 51049781
3-(2,2-dimethylpropanoylamino)-N-naphthalen-1-ylbenzamide
CID 35186877
3-(2,2-dimethylpropanoylamino)-N-(2-propan-2-ylphenyl)benzamide
CID 35207652
N-(2-ethoxyphenyl)-3-[(2-naphthalen-1-yloxyacetyl)amino]benzamide
CID 11841398
N-(2-ethoxyphenyl)-3-[(2-methylphenyl)sulfonylamino]benzamide
CID 1020106
5-bromo-N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 55771323
ethyl N-[3-[(2-methoxyphenyl)carbamoyl]phenyl]carbamate
CID 17415342
1-N-(3-chlorophenyl)-4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide
CID 109049963
2-[[3-[(2-ethoxybenzoyl)amino]benzoyl]amino]benzoic acid
CID 2204072
2-[[3-(2,2-dimethylpropanoylamino)benzoyl]amino]benzoate
CID 4200241
N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 42943946

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide?
The IUPAC name of 3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide (CID 35339665) is 3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide.
What is the SMILES notation for 3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide?
The canonical SMILES for 3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide is CCOc1ccccc1NC(=O)c1cccc(NC(=O)C(C)(C)C)c1.
What is the InChIKey of 3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide?
The InChIKey is LHYHMSKPWHMYRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-5-25-17-12-7-6-11-16(17)22-18(23)14-9-8-10-15(13-14)21-19(24)20(2,3)4/h6-13H,5H2,1-4H3,(H,21,24)(H,22,23).
What are the key properties of 3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide?
3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide has a molecular weight of 340.42 g/mol, XLogP of 4.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-dimethylpropanoylamino)-N-(2-ethoxyphenyl)benzamide is sourced from PubChem (CID 35339665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).