N-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide

C16H18N2O — CID 135260414

IUPACN-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide
SMILESCC(=O)Nc1cccc(C)c1-c1c(C)cccc1N
InChIInChI=1S/C16H18N2O/c1-10-6-4-8-13(17)15(10)16-11(2)7-5-9-14(16)18-12(3)19/h4-9H,17H2,1-3H3,(H,18,19)
InChIKeyKPLSUCLNOGXSQC-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.51
Rot. Bonds2

About N-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide

N-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide (PubChem CID 135260414) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide
PubChem CID135260414
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide
SMILESCC(=O)Nc1cccc(C)c1-c1c(C)cccc1N
InChIInChI=1S/C16H18N2O/c1-10-6-4-8-13(17)15(10)16-11(2)7-5-9-14(16)18-12(3)19/h4-9H,17H2,1-3H3,(H,18,19)
InChIKeyKPLSUCLNOGXSQC-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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Related Compounds

N-[2-(2-acetamido-6-methylphenyl)-3-methylphenyl]acetamide
CID 22971546
N-(5-amino-9,10-dioxoanthracen-1-yl)acetamide;N-(5-amino-9,10-dioxoanthracen-1-yl)benzamide
CID 19828301
N-(3-amino-2-fluorophenyl)acetamide
CID 23022555
ethane;N-(2-fluoro-3-methylphenyl)acetamide
CID 145070564
2-acetamido-6-methylbenzoic acid
CID 2801400
N-[2-(hydroxymethyl)-3-methylphenyl]acetamide
CID 14368464
N-[3-methyl-2-[2-methyl-6-[[2-(trihydroxy-λ4-sulfanyl)acetyl]amino]phenyl]phenyl]-2-(trihydroxy-λ4-sulfanyl)acetamide
CID 22971542
2-amino-N-(2-cyanophenyl)-6-methylbenzamide
CID 16781189
2-amino-N-(2-chlorophenyl)-6-methylbenzamide
CID 16785685
4-acetamido-N-(2-aminophenyl)benzamide
CID 2746
2-amino-6-methoxy-N-(2-methylphenyl)benzamide
CID 81410704
3-amino-N-(2-chloro-3-methylphenyl)benzamide
CID 113266907

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide?
The IUPAC name of N-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide (CID 135260414) is N-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide.
What is the SMILES notation for N-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide?
The canonical SMILES for N-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide is CC(=O)Nc1cccc(C)c1-c1c(C)cccc1N.
What is the InChIKey of N-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide?
The InChIKey is KPLSUCLNOGXSQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-10-6-4-8-13(17)15(10)16-11(2)7-5-9-14(16)18-12(3)19/h4-9H,17H2,1-3H3,(H,18,19).
What are the key properties of N-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide?
N-[2-(2-amino-6-methylphenyl)-3-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-[2-(2-amino-6-methylphenyl)-3-methylphenyl]acetamide is sourced from PubChem (CID 135260414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).