2-ethenylbenzamide

C9H9NO — CID 12541481

IUPAC2-ethenylbenzamide
SMILESC=Cc1ccccc1C(N)=O
InChIInChI=1S/C9H9NO/c1-2-7-5-3-4-6-8(7)9(10)11/h2-6H,1H2,(H2,10,11)
InChIKeyCWIAYCPUWVIULX-UHFFFAOYSA-N
MW147.18 g/mol
LogP1.43
Rot. Bonds2

About 2-ethenylbenzamide

2-ethenylbenzamide (PubChem CID 12541481) has the molecular formula C9H9NO and a molecular weight of 147.18 g/mol. Its IUPAC name is 2-ethenylbenzamide.

Molecular Properties

Compound Name2-ethenylbenzamide
PubChem CID12541481
Molecular FormulaC9H9NO
Molecular Weight147.18 g/mol
Exact Mass147.07
IUPAC Name2-ethenylbenzamide
SMILESC=Cc1ccccc1C(N)=O
InChIInChI=1S/C9H9NO/c1-2-7-5-3-4-6-8(7)9(10)11/h2-6H,1H2,(H2,10,11)
InChIKeyCWIAYCPUWVIULX-UHFFFAOYSA-N
XLogP1.43
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Benzamide
CID 2331
Benzeneacetamide
CID 7680
N-Methylbenzamide
CID 11954
Benzoylhydrazine
CID 11955
Phthalamide
CID 6956
Benzohydroxamic acid
CID 10313
2,6-Difluorobenzamide
CID 87439
2-Trifluoromethylbenzamide
CID 67759
4-Fluorobenzamide
CID 71572
2-Methyl-N,N-diethylbenzamide
CID 75945
4-Methylbenzamide
CID 69274
2-Methylbenzamide
CID 10704

Frequently Asked Questions

What is the IUPAC name of 2-ethenylbenzamide?
The IUPAC name of 2-ethenylbenzamide (CID 12541481) is 2-ethenylbenzamide.
What is the SMILES notation for 2-ethenylbenzamide?
The canonical SMILES for 2-ethenylbenzamide is C=Cc1ccccc1C(N)=O.
What is the InChIKey of 2-ethenylbenzamide?
The InChIKey is CWIAYCPUWVIULX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9NO/c1-2-7-5-3-4-6-8(7)9(10)11/h2-6H,1H2,(H2,10,11).
What are the key properties of 2-ethenylbenzamide?
2-ethenylbenzamide has a molecular weight of 147.18 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenylbenzamide is sourced from PubChem (CID 12541481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).