N-(2-anilino-2-oxoethyl)-4-methylbenzamide

C16H16N2O2 — CID 4010991

IUPACN-(2-anilino-2-oxoethyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)NCC(=O)Nc2ccccc2)cc1
InChIInChI=1S/C16H16N2O2/c1-12-7-9-13(10-8-12)16(20)17-11-15(19)18-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H,17,20)(H,18,19)
InChIKeyUCFZUECWNYMLRB-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.36
Rot. Bonds4

About N-(2-anilino-2-oxoethyl)-4-methylbenzamide

N-(2-anilino-2-oxoethyl)-4-methylbenzamide (PubChem CID 4010991) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-(2-anilino-2-oxoethyl)-4-methylbenzamide.

Molecular Properties

Compound NameN-(2-anilino-2-oxoethyl)-4-methylbenzamide
PubChem CID4010991
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC NameN-(2-anilino-2-oxoethyl)-4-methylbenzamide
SMILESCc1ccc(C(=O)NCC(=O)Nc2ccccc2)cc1
InChIInChI=1S/C16H16N2O2/c1-12-7-9-13(10-8-12)16(20)17-11-15(19)18-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H,17,20)(H,18,19)
InChIKeyUCFZUECWNYMLRB-UHFFFAOYSA-N
XLogP2.36
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-N-[2-(4-methylanilino)-2-oxoethyl]benzamide
CID 2989490
N-[2-(3-acetylanilino)-2-oxoethyl]-4-methylbenzamide
CID 34830762
N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 2968363
4-methyl-N-[2-oxo-2-[4-(trifluoromethyl)anilino]ethyl]benzamide
CID 770701
N-[2-(4-bromoanilino)-2-oxoethyl]-4-(phenylcarbamoylamino)benzamide
CID 55960943
N-[2-(3,5-dichloroanilino)-2-oxoethyl]-4-methylbenzamide
CID 46756068
3,4-dimethyl-N-[2-oxo-2-(4-phenylanilino)ethyl]benzamide
CID 9414724
N-(2-hydrazinyl-2-oxoethyl)-4-methylbenzamide
CID 17349905
N-[2-(3-methoxyanilino)-2-oxoethyl]-4-phenylbenzamide
CID 36915136
4-(4-methylphenyl)-4-oxo-N-phenylbutanamide
CID 956933
N-[2-(2,6-difluoroanilino)-2-oxoethyl]-4-methylbenzamide
CID 46745022
N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]-4-(phenylcarbamoylamino)benzamide
CID 46551082

Frequently Asked Questions

What is the IUPAC name of N-(2-anilino-2-oxoethyl)-4-methylbenzamide?
The IUPAC name of N-(2-anilino-2-oxoethyl)-4-methylbenzamide (CID 4010991) is N-(2-anilino-2-oxoethyl)-4-methylbenzamide.
What is the SMILES notation for N-(2-anilino-2-oxoethyl)-4-methylbenzamide?
The canonical SMILES for N-(2-anilino-2-oxoethyl)-4-methylbenzamide is Cc1ccc(C(=O)NCC(=O)Nc2ccccc2)cc1.
What is the InChIKey of N-(2-anilino-2-oxoethyl)-4-methylbenzamide?
The InChIKey is UCFZUECWNYMLRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-12-7-9-13(10-8-12)16(20)17-11-15(19)18-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H,17,20)(H,18,19).
What are the key properties of N-(2-anilino-2-oxoethyl)-4-methylbenzamide?
N-(2-anilino-2-oxoethyl)-4-methylbenzamide has a molecular weight of 268.32 g/mol, XLogP of 2.36, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-anilino-2-oxoethyl)-4-methylbenzamide is sourced from PubChem (CID 4010991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).