4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide

C19H22N2O2 — CID 18195087

IUPAC4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide
SMILESCC(=O)NCc1ccc(C(=O)NCCc2ccccc2C)cc1
InChIInChI=1S/C19H22N2O2/c1-14-5-3-4-6-17(14)11-12-20-19(23)18-9-7-16(8-10-18)13-21-15(2)22/h3-10H,11-13H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyHFCCTOQQKOBALZ-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.60
Rot. Bonds6

About 4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide

4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide (PubChem CID 18195087) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide.

Molecular Properties

Compound Name4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide
PubChem CID18195087
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide
SMILESCC(=O)NCc1ccc(C(=O)NCCc2ccccc2C)cc1
InChIInChI=1S/C19H22N2O2/c1-14-5-3-4-6-17(14)11-12-20-19(23)18-9-7-16(8-10-18)13-21-15(2)22/h3-10H,11-13H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyHFCCTOQQKOBALZ-UHFFFAOYSA-N
XLogP2.60
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[2-(2-methylphenyl)ethylcarbamoylamino]methyl]benzoic acid
CID 108899701
N-[2-(2-methylphenyl)ethyl]-1-oxidopyridin-1-ium-4-carboxamide
CID 27164026
4-(acetamidomethyl)-N-(2-methylphenyl)benzamide
CID 18104261
4-hydroxy-3-methyl-N-[2-(2-methylphenyl)ethyl]benzamide
CID 103956274
3,4-dichloro-N-[2-(2-methylphenyl)ethyl]benzamide
CID 27837884
4-(difluoromethoxy)-N-[2-(2-methylphenyl)ethyl]benzamide
CID 27837749
4-N-[(2-methylphenyl)methyl]-1-N-(3-phenylpropyl)benzene-1,4-dicarboxamide
CID 109046799
4-(acetamidomethyl)-N-ethylbenzamide
CID 20648409
1-N-[2-(dimethylamino)ethyl]-4-N-[(2-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109045710
3-hydroxy-4-iodo-N-[2-(2-methylphenyl)ethyl]benzamide
CID 104627455
4-(acetamidomethyl)-N-[2-(1H-benzimidazol-2-yl)ethyl]benzamide
CID 17394585
4-amino-3-bromo-N-[2-(2-methylphenyl)ethyl]benzamide
CID 79749765

Frequently Asked Questions

What is the IUPAC name of 4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide?
The IUPAC name of 4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide (CID 18195087) is 4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide.
What is the SMILES notation for 4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide?
The canonical SMILES for 4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide is CC(=O)NCc1ccc(C(=O)NCCc2ccccc2C)cc1.
What is the InChIKey of 4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide?
The InChIKey is HFCCTOQQKOBALZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-14-5-3-4-6-17(14)11-12-20-19(23)18-9-7-16(8-10-18)13-21-15(2)22/h3-10H,11-13H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of 4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide?
4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide has a molecular weight of 310.40 g/mol, XLogP of 2.60, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(acetamidomethyl)-N-[2-(2-methylphenyl)ethyl]benzamide is sourced from PubChem (CID 18195087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).