N-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide

C18H20N2O2 — CID 626583

IUPACN-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2ccc(NC(C)=O)c(C)c2)cc1C
InChIInChI=1S/C18H20N2O2/c1-11-9-15(5-7-17(11)19-13(3)21)16-6-8-18(12(2)10-16)20-14(4)22/h5-10H,1-4H3,(H,19,21)(H,20,22)
InChIKeyYYWOGMJTPSCQAN-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.89
Rot. Bonds3

About N-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide

N-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide (PubChem CID 626583) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is N-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide
PubChem CID626583
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC NameN-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2ccc(NC(C)=O)c(C)c2)cc1C
InChIInChI=1S/C18H20N2O2/c1-11-9-15(5-7-17(11)19-13(3)21)16-6-8-18(12(2)10-16)20-14(4)22/h5-10H,1-4H3,(H,19,21)(H,20,22)
InChIKeyYYWOGMJTPSCQAN-UHFFFAOYSA-N
XLogP3.89
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide?
The IUPAC name of N-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide (CID 626583) is N-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide.
What is the SMILES notation for N-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide?
The canonical SMILES for N-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide is CC(=O)Nc1ccc(-c2ccc(NC(C)=O)c(C)c2)cc1C.
What is the InChIKey of N-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide?
The InChIKey is YYWOGMJTPSCQAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-11-9-15(5-7-17(11)19-13(3)21)16-6-8-18(12(2)10-16)20-14(4)22/h5-10H,1-4H3,(H,19,21)(H,20,22).
What are the key properties of N-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide?
N-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide has a molecular weight of 296.37 g/mol, XLogP of 3.89, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-acetamido-3-methylphenyl)-2-methylphenyl]acetamide is sourced from PubChem (CID 626583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).