N-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide

C19H22N2O3 — CID 170710846

IUPACN-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide
SMILESCOCCN(C(=O)c1ccc(C)cc1C)c1ccccc1C(N)=O
InChIInChI=1S/C19H22N2O3/c1-13-8-9-15(14(2)12-13)19(23)21(10-11-24-3)17-7-5-4-6-16(17)18(20)22/h4-9,12H,10-11H2,1-3H3,(H2,20,22)
InChIKeyKAGLUGHZCAGKLR-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.70
Rot. Bonds6

About N-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide

N-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide (PubChem CID 170710846) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide.

Molecular Properties

Compound NameN-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide
PubChem CID170710846
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide
SMILESCOCCN(C(=O)c1ccc(C)cc1C)c1ccccc1C(N)=O
InChIInChI=1S/C19H22N2O3/c1-13-8-9-15(14(2)12-13)19(23)21(10-11-24-3)17-7-5-4-6-16(17)18(20)22/h4-9,12H,10-11H2,1-3H3,(H2,20,22)
InChIKeyKAGLUGHZCAGKLR-UHFFFAOYSA-N
XLogP2.70
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide?
The IUPAC name of N-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide (CID 170710846) is N-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide.
What is the SMILES notation for N-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide?
The canonical SMILES for N-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide is COCCN(C(=O)c1ccc(C)cc1C)c1ccccc1C(N)=O.
What is the InChIKey of N-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide?
The InChIKey is KAGLUGHZCAGKLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-13-8-9-15(14(2)12-13)19(23)21(10-11-24-3)17-7-5-4-6-16(17)18(20)22/h4-9,12H,10-11H2,1-3H3,(H2,20,22).
What are the key properties of N-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide?
N-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide has a molecular weight of 326.40 g/mol, XLogP of 2.70, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbamoylphenyl)-N-(2-methoxyethyl)-2,4-dimethylbenzamide is sourced from PubChem (CID 170710846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).