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

C16H18N2O — CID 19074

IUPACN-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2ccc(N)c(C)c2)cc1C
InChIInChI=1S/C16H18N2O/c1-10-8-13(4-6-15(10)17)14-5-7-16(11(2)9-14)18-12(3)19/h4-9H,17H2,1-3H3,(H,18,19)
InChIKeyGHTBEGLKAXDXCH-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.51
Rot. Bonds2

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

N-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide (PubChem CID 19074) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide
PubChem CID19074
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2ccc(N)c(C)c2)cc1C
InChIInChI=1S/C16H18N2O/c1-10-8-13(4-6-15(10)17)14-5-7-16(11(2)9-14)18-12(3)19/h4-9H,17H2,1-3H3,(H,18,19)
InChIKeyGHTBEGLKAXDXCH-UHFFFAOYSA-N
XLogP3.51
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide?
The IUPAC name of N-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide (CID 19074) is N-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide.
What is the SMILES notation for N-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide?
The canonical SMILES for N-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide is CC(=O)Nc1ccc(-c2ccc(N)c(C)c2)cc1C.
What is the InChIKey of N-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide?
The InChIKey is GHTBEGLKAXDXCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-10-8-13(4-6-15(10)17)14-5-7-16(11(2)9-14)18-12(3)19/h4-9H,17H2,1-3H3,(H,18,19).
What are the key properties of N-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide?
N-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide has a molecular weight of 254.33 g/mol, XLogP of 3.51, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide is sourced from PubChem (CID 19074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).