N-[1-(2-methylphenyl)ethenyl]acetamide

C11H13NO — CID 15261578

IUPACN-[1-(2-methylphenyl)ethenyl]acetamide
SMILESC=C(NC(C)=O)c1ccccc1C
InChIInChI=1S/C11H13NO/c1-8-6-4-5-7-11(8)9(2)12-10(3)13/h4-7H,2H2,1,3H3,(H,12,13)
InChIKeyLHNRYBHXPIJUMP-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.10
Rot. Bonds2

About N-[1-(2-methylphenyl)ethenyl]acetamide

N-[1-(2-methylphenyl)ethenyl]acetamide (PubChem CID 15261578) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is N-[1-(2-methylphenyl)ethenyl]acetamide.

Molecular Properties

Compound NameN-[1-(2-methylphenyl)ethenyl]acetamide
PubChem CID15261578
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC NameN-[1-(2-methylphenyl)ethenyl]acetamide
SMILESC=C(NC(C)=O)c1ccccc1C
InChIInChI=1S/C11H13NO/c1-8-6-4-5-7-11(8)9(2)12-10(3)13/h4-7H,2H2,1,3H3,(H,12,13)
InChIKeyLHNRYBHXPIJUMP-UHFFFAOYSA-N
XLogP2.10
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methylphenyl)ethenyl]acetamide?
The IUPAC name of N-[1-(2-methylphenyl)ethenyl]acetamide (CID 15261578) is N-[1-(2-methylphenyl)ethenyl]acetamide.
What is the SMILES notation for N-[1-(2-methylphenyl)ethenyl]acetamide?
The canonical SMILES for N-[1-(2-methylphenyl)ethenyl]acetamide is C=C(NC(C)=O)c1ccccc1C.
What is the InChIKey of N-[1-(2-methylphenyl)ethenyl]acetamide?
The InChIKey is LHNRYBHXPIJUMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-8-6-4-5-7-11(8)9(2)12-10(3)13/h4-7H,2H2,1,3H3,(H,12,13).
What are the key properties of N-[1-(2-methylphenyl)ethenyl]acetamide?
N-[1-(2-methylphenyl)ethenyl]acetamide has a molecular weight of 175.23 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methylphenyl)ethenyl]acetamide is sourced from PubChem (CID 15261578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).