N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide

C17H18N2O3 — CID 95970601

IUPACN-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide
SMILESCCOc1ccc(C(=O)Nc2ccccc2C(N)=O)cc1C
InChIInChI=1S/C17H18N2O3/c1-3-22-15-9-8-12(10-11(15)2)17(21)19-14-7-5-4-6-13(14)16(18)20/h4-10H,3H2,1-2H3,(H2,18,20)(H,19,21)
InChIKeyKRYKCXLGOXNLNF-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.74
Rot. Bonds5

About N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide

N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide (PubChem CID 95970601) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide.

Molecular Properties

Compound NameN-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide
PubChem CID95970601
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC NameN-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide
SMILESCCOc1ccc(C(=O)Nc2ccccc2C(N)=O)cc1C
InChIInChI=1S/C17H18N2O3/c1-3-22-15-9-8-12(10-11(15)2)17(21)19-14-7-5-4-6-13(14)16(18)20/h4-10H,3H2,1-2H3,(H2,18,20)(H,19,21)
InChIKeyKRYKCXLGOXNLNF-UHFFFAOYSA-N
XLogP2.74
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethoxy-3-methyl-N-(2-propan-2-yloxyphenyl)benzamide
CID 86938124
3,4-diethoxy-N-[2-(methylcarbamoyl)phenyl]benzamide
CID 34752310
4-N-(2-ethoxyphenyl)benzene-1,4-dicarboxamide
CID 30843274
N-[2-carbamoyl-4-(dimethylamino)phenyl]-3,4-diethoxybenzamide
CID 75397296
N-[2-(butanoylamino)phenyl]-3,4-diethoxybenzamide
CID 1307408
N-(2,6-dichlorophenyl)-4-ethoxy-3-methylbenzamide
CID 30147579
4-ethoxy-3-methyl-N-(4-phenylmethoxyphenyl)benzamide
CID 30147613
3,4-diethoxy-N-(2-methoxyphenyl)benzamide
CID 669527
1-N,3-N-bis(2-ethoxyphenyl)-4-methoxybenzene-1,3-dicarboxamide
CID 141155437
ethyl 2-[[3-[(2-ethoxycarbonylphenyl)carbamoyl]benzoyl]amino]benzoate
CID 4013454
2-[3-(3,4-diethoxyphenyl)propanoylamino]benzamide
CID 30395458
4-N-(2-carbamoylphenyl)benzene-1,4-dicarboxamide
CID 71944310

Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide?
The IUPAC name of N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide (CID 95970601) is N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide.
What is the SMILES notation for N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide?
The canonical SMILES for N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide is CCOc1ccc(C(=O)Nc2ccccc2C(N)=O)cc1C.
What is the InChIKey of N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide?
The InChIKey is KRYKCXLGOXNLNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-3-22-15-9-8-12(10-11(15)2)17(21)19-14-7-5-4-6-13(14)16(18)20/h4-10H,3H2,1-2H3,(H2,18,20)(H,19,21).
What are the key properties of N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide?
N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide has a molecular weight of 298.34 g/mol, XLogP of 2.74, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbamoylphenyl)-4-ethoxy-3-methylbenzamide is sourced from PubChem (CID 95970601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).