3-[(ethenylamino)methyl]-N-methylbenzamide

C11H14N2O — CID 156799319

IUPAC3-[(ethenylamino)methyl]-N-methylbenzamide
SMILESC=CNCc1cccc(C(=O)NC)c1
InChIInChI=1S/C11H14N2O/c1-3-13-8-9-5-4-6-10(7-9)11(14)12-2/h3-7,13H,1,8H2,2H3,(H,12,14)
InChIKeyGXPLVWFWWJWYLE-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.28
Rot. Bonds4

About 3-[(ethenylamino)methyl]-N-methylbenzamide

3-[(ethenylamino)methyl]-N-methylbenzamide (PubChem CID 156799319) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 3-[(ethenylamino)methyl]-N-methylbenzamide.

Molecular Properties

Compound Name3-[(ethenylamino)methyl]-N-methylbenzamide
PubChem CID156799319
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name3-[(ethenylamino)methyl]-N-methylbenzamide
SMILESC=CNCc1cccc(C(=O)NC)c1
InChIInChI=1S/C11H14N2O/c1-3-13-8-9-5-4-6-10(7-9)11(14)12-2/h3-7,13H,1,8H2,2H3,(H,12,14)
InChIKeyGXPLVWFWWJWYLE-UHFFFAOYSA-N
XLogP1.28
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-N-methylbenzamide
CID 59115297
3-(aminomethyl)-N-methylbenzamide;ethane
CID 143416429
N-methyl-3-[[4-(methylamino)butanoylamino]methyl]benzamide
CID 119719954
3-(cyanomethyl)-N-methylbenzamide
CID 69441046
3-[[(N-benzyl-N'-methylcarbamimidoyl)amino]methyl]-N-methylbenzamide;hydroiodide
CID 110952739
ethane;3-(formamidomethyl)-N-methylbenzamide;N-propan-2-ylcyclohexanecarboxamide
CID 165121846
N-methyl-3-[[[5-methyl-2-[[3-(methylcarbamoyl)phenyl]methylamino]pyrimidin-4-yl]amino]methyl]benzamide
CID 133349118
3-[[[amino-(prop-2-enylamino)methylidene]amino]methyl]-N-methylbenzamide
CID 110918655
3-amino-N-[[3-(methylcarbamoyl)phenyl]methyl]pyrazine-2-carboxamide
CID 32916582
ethane;3-(formamidomethyl)-N-propan-2-ylbenzamide
CID 143975771
3-[[(N,N'-dimethyl-N-pent-4-enylcarbamimidoyl)amino]methyl]-N-methylbenzamide
CID 109496049
N-methyl-3-[(2-phenylbutanoylamino)methyl]benzamide
CID 46592660

Frequently Asked Questions

What is the IUPAC name of 3-[(ethenylamino)methyl]-N-methylbenzamide?
The IUPAC name of 3-[(ethenylamino)methyl]-N-methylbenzamide (CID 156799319) is 3-[(ethenylamino)methyl]-N-methylbenzamide.
What is the SMILES notation for 3-[(ethenylamino)methyl]-N-methylbenzamide?
The canonical SMILES for 3-[(ethenylamino)methyl]-N-methylbenzamide is C=CNCc1cccc(C(=O)NC)c1.
What is the InChIKey of 3-[(ethenylamino)methyl]-N-methylbenzamide?
The InChIKey is GXPLVWFWWJWYLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-3-13-8-9-5-4-6-10(7-9)11(14)12-2/h3-7,13H,1,8H2,2H3,(H,12,14).
What are the key properties of 3-[(ethenylamino)methyl]-N-methylbenzamide?
3-[(ethenylamino)methyl]-N-methylbenzamide has a molecular weight of 190.25 g/mol, XLogP of 1.28, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(ethenylamino)methyl]-N-methylbenzamide is sourced from PubChem (CID 156799319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).