N-[2-(3-methylanilino)-2-oxoethyl]benzamide

C16H16N2O2 — CID 2968363

IUPACN-[2-(3-methylanilino)-2-oxoethyl]benzamide
SMILESCc1cccc(NC(=O)CNC(=O)c2ccccc2)c1
InChIInChI=1S/C16H16N2O2/c1-12-6-5-9-14(10-12)18-15(19)11-17-16(20)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,17,20)(H,18,19)
InChIKeyJWTCAGZLIYPPDR-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.36
Rot. Bonds4

About N-[2-(3-methylanilino)-2-oxoethyl]benzamide

N-[2-(3-methylanilino)-2-oxoethyl]benzamide (PubChem CID 2968363) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-[2-(3-methylanilino)-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-(3-methylanilino)-2-oxoethyl]benzamide
PubChem CID2968363
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC NameN-[2-(3-methylanilino)-2-oxoethyl]benzamide
SMILESCc1cccc(NC(=O)CNC(=O)c2ccccc2)c1
InChIInChI=1S/C16H16N2O2/c1-12-6-5-9-14(10-12)18-15(19)11-17-16(20)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,17,20)(H,18,19)
InChIKeyJWTCAGZLIYPPDR-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

3,5-dimethyl-N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 26537864
3-chloro-N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 772080
N-[2-(3-acetamidoanilino)-2-oxoethyl]-3-methylbenzamide
CID 26584037
N-(2-anilino-2-oxoethyl)-4-methylbenzamide
CID 4010991
N-[2-(3-acetylanilino)-2-oxoethyl]-4-methylbenzamide
CID 34830762
N-[2-(3-methoxyanilino)-2-oxoethyl]-3-methylbenzamide
CID 4679398
3,4,5-trimethoxy-N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 27166909
N-[2-[3-(cyclopropanecarbonylamino)anilino]-2-oxoethyl]benzamide
CID 38325655
N-(3-methylphenyl)-4-oxo-4-phenylbutanamide
CID 7779680
4-(diethylsulfamoyl)-N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 9341770
N-[2-(3-methylanilino)-2-oxoethyl]-4-(propan-2-ylsulfamoyl)benzamide
CID 9038896
N-methyl-N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 35553197

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methylanilino)-2-oxoethyl]benzamide?
The IUPAC name of N-[2-(3-methylanilino)-2-oxoethyl]benzamide (CID 2968363) is N-[2-(3-methylanilino)-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-(3-methylanilino)-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-(3-methylanilino)-2-oxoethyl]benzamide is Cc1cccc(NC(=O)CNC(=O)c2ccccc2)c1.
What is the InChIKey of N-[2-(3-methylanilino)-2-oxoethyl]benzamide?
The InChIKey is JWTCAGZLIYPPDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-12-6-5-9-14(10-12)18-15(19)11-17-16(20)13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,17,20)(H,18,19).
What are the key properties of N-[2-(3-methylanilino)-2-oxoethyl]benzamide?
N-[2-(3-methylanilino)-2-oxoethyl]benzamide 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-(3-methylanilino)-2-oxoethyl]benzamide is sourced from PubChem (CID 2968363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).