2-methoxy-N-prop-2-enylbenzamide

C11H13NO2 — CID 4063222

IUPAC2-methoxy-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccccc1OC
InChIInChI=1S/C11H13NO2/c1-3-8-12-11(13)9-6-4-5-7-10(9)14-2/h3-7H,1,8H2,2H3,(H,12,13)
InChIKeyOHTURBHELJKCQC-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.61
Rot. Bonds4

About 2-methoxy-N-prop-2-enylbenzamide

2-methoxy-N-prop-2-enylbenzamide (PubChem CID 4063222) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is 2-methoxy-N-prop-2-enylbenzamide.

Molecular Properties

Compound Name2-methoxy-N-prop-2-enylbenzamide
PubChem CID4063222
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name2-methoxy-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccccc1OC
InChIInChI=1S/C11H13NO2/c1-3-8-12-11(13)9-6-4-5-7-10(9)14-2/h3-7H,1,8H2,2H3,(H,12,13)
InChIKeyOHTURBHELJKCQC-UHFFFAOYSA-N
XLogP1.61
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2,6-dimethoxy-N-prop-2-enylbenzamide
CID 3569670
2,3,4-trimethoxy-N-prop-2-enylbenzamide
CID 7971428
2-butoxy-N-prop-2-enylbenzamide
CID 4941031
2-[(2-methoxyphenyl)sulfonylamino]-N-prop-2-enylbenzamide
CID 51170213
4-methoxy-2,3-dimethyl-N-prop-2-enylbenzamide
CID 110763144
1-(2-methoxyphenyl)-2-(prop-2-enylamino)propan-1-one
CID 82100978
2,4-dimethoxy-3-methyl-N-prop-2-enylbenzamide
CID 110763319
2-methoxybenzohydrazide
CID 24051
2,6-dimethoxy-N-[2-[(2-methoxybenzoyl)amino]ethyl]benzamide
CID 108538022
2-hydroxy-N-[2-[(2-methoxybenzoyl)amino]ethyl]benzamide
CID 108538036
2-fluoro-N-prop-2-enylbenzamide
CID 4125319
N-[2-[(2-chlorobenzoyl)amino]ethyl]-2-methoxybenzamide
CID 40718510

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-prop-2-enylbenzamide?
The IUPAC name of 2-methoxy-N-prop-2-enylbenzamide (CID 4063222) is 2-methoxy-N-prop-2-enylbenzamide.
What is the SMILES notation for 2-methoxy-N-prop-2-enylbenzamide?
The canonical SMILES for 2-methoxy-N-prop-2-enylbenzamide is C=CCNC(=O)c1ccccc1OC.
What is the InChIKey of 2-methoxy-N-prop-2-enylbenzamide?
The InChIKey is OHTURBHELJKCQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c1-3-8-12-11(13)9-6-4-5-7-10(9)14-2/h3-7H,1,8H2,2H3,(H,12,13).
What are the key properties of 2-methoxy-N-prop-2-enylbenzamide?
2-methoxy-N-prop-2-enylbenzamide has a molecular weight of 191.23 g/mol, XLogP of 1.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-prop-2-enylbenzamide is sourced from PubChem (CID 4063222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).