5-ethenyl-N-ethyl-2-methylbenzamide

C12H15NO — CID 154815188

IUPAC5-ethenyl-N-ethyl-2-methylbenzamide
SMILESC=Cc1ccc(C)c(C(=O)NCC)c1
InChIInChI=1S/C12H15NO/c1-4-10-7-6-9(3)11(8-10)12(14)13-5-2/h4,6-8H,1,5H2,2-3H3,(H,13,14)
InChIKeySZGZFSHBNFLKMS-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.39
Rot. Bonds3

About 5-ethenyl-N-ethyl-2-methylbenzamide

5-ethenyl-N-ethyl-2-methylbenzamide (PubChem CID 154815188) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is 5-ethenyl-N-ethyl-2-methylbenzamide.

Molecular Properties

Compound Name5-ethenyl-N-ethyl-2-methylbenzamide
PubChem CID154815188
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name5-ethenyl-N-ethyl-2-methylbenzamide
SMILESC=Cc1ccc(C)c(C(=O)NCC)c1
InChIInChI=1S/C12H15NO/c1-4-10-7-6-9(3)11(8-10)12(14)13-5-2/h4,6-8H,1,5H2,2-3H3,(H,13,14)
InChIKeySZGZFSHBNFLKMS-UHFFFAOYSA-N
XLogP2.39
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-ethenyl-N-ethyl-2-(trifluoromethyl)benzamide
CID 171361983
1-(5-ethenyl-2-methylphenyl)ethanone
CID 143958265
methyl 5-ethenyl-2-methylbenzoate
CID 10702422
N-[2-(ethylamino)-2-oxoethyl]-2-methyl-5-sulfanylbenzamide
CID 107023107
6-ethenyl-1-methyl-N-pentylindole-3-carboxamide
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3-[3-(2-ethoxyethylcarbamoyl)-4-methylphenyl]prop-2-enoic acid
CID 77064809
5-bromo-2-methyl-N-[2-(prop-2-enoylamino)ethyl]benzamide
CID 71998630
5-amino-N-(2,2-dimethylbutyl)-2-methylbenzamide
CID 103459942
3-[4-methyl-3-(3,3,3-trifluoropropylcarbamoyl)phenyl]prop-2-enoic acid
CID 77064719
(E)-3-[3-(ethylcarbamoyl)-4-fluorophenyl]prop-2-enoic acid
CID 94231056
4-methyl-3-(prop-2-enylcarbamoyl)benzenesulfonyl chloride
CID 61292327
4-chloro-2-methyl-N-prop-2-enylbenzamide
CID 103775370

Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-N-ethyl-2-methylbenzamide?
The IUPAC name of 5-ethenyl-N-ethyl-2-methylbenzamide (CID 154815188) is 5-ethenyl-N-ethyl-2-methylbenzamide.
What is the SMILES notation for 5-ethenyl-N-ethyl-2-methylbenzamide?
The canonical SMILES for 5-ethenyl-N-ethyl-2-methylbenzamide is C=Cc1ccc(C)c(C(=O)NCC)c1.
What is the InChIKey of 5-ethenyl-N-ethyl-2-methylbenzamide?
The InChIKey is SZGZFSHBNFLKMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c1-4-10-7-6-9(3)11(8-10)12(14)13-5-2/h4,6-8H,1,5H2,2-3H3,(H,13,14).
What are the key properties of 5-ethenyl-N-ethyl-2-methylbenzamide?
5-ethenyl-N-ethyl-2-methylbenzamide has a molecular weight of 189.26 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-N-ethyl-2-methylbenzamide is sourced from PubChem (CID 154815188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).