N-(4-butyl-2-methylphenyl)acetamide

C13H19NO — CID 2747581

IUPACN-(4-butyl-2-methylphenyl)acetamide
SMILESCCCCc1ccc(NC(C)=O)c(C)c1
InChIInChI=1S/C13H19NO/c1-4-5-6-12-7-8-13(10(2)9-12)14-11(3)15/h7-9H,4-6H2,1-3H3,(H,14,15)
InChIKeyZFVMECVBUGMWIX-UHFFFAOYSA-N
MW205.30 g/mol
LogP3.30
Rot. Bonds4

About N-(4-butyl-2-methylphenyl)acetamide

N-(4-butyl-2-methylphenyl)acetamide (PubChem CID 2747581) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is N-(4-butyl-2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(4-butyl-2-methylphenyl)acetamide
PubChem CID2747581
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC NameN-(4-butyl-2-methylphenyl)acetamide
SMILESCCCCc1ccc(NC(C)=O)c(C)c1
InChIInChI=1S/C13H19NO/c1-4-5-6-12-7-8-13(10(2)9-12)14-11(3)15/h7-9H,4-6H2,1-3H3,(H,14,15)
InChIKeyZFVMECVBUGMWIX-UHFFFAOYSA-N
XLogP3.30
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(4-butyl-2-methylphenyl)acetamide?
The IUPAC name of N-(4-butyl-2-methylphenyl)acetamide (CID 2747581) is N-(4-butyl-2-methylphenyl)acetamide.
What is the SMILES notation for N-(4-butyl-2-methylphenyl)acetamide?
The canonical SMILES for N-(4-butyl-2-methylphenyl)acetamide is CCCCc1ccc(NC(C)=O)c(C)c1.
What is the InChIKey of N-(4-butyl-2-methylphenyl)acetamide?
The InChIKey is ZFVMECVBUGMWIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-4-5-6-12-7-8-13(10(2)9-12)14-11(3)15/h7-9H,4-6H2,1-3H3,(H,14,15).
What are the key properties of N-(4-butyl-2-methylphenyl)acetamide?
N-(4-butyl-2-methylphenyl)acetamide has a molecular weight of 205.30 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-butyl-2-methylphenyl)acetamide is sourced from PubChem (CID 2747581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).