4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide

C15H24N2O2 — CID 106451707

IUPAC4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide
SMILESCCCOCCNCCNC(=O)c1ccc(C)cc1
InChIInChI=1S/C15H24N2O2/c1-3-11-19-12-10-16-8-9-17-15(18)14-6-4-13(2)5-7-14/h4-7,16H,3,8-12H2,1-2H3,(H,17,18)
InChIKeyJTSCXHMTRYLGPT-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.74
Rot. Bonds9

About 4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide

4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide (PubChem CID 106451707) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide.

Molecular Properties

Compound Name4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide
PubChem CID106451707
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide
SMILESCCCOCCNCCNC(=O)c1ccc(C)cc1
InChIInChI=1S/C15H24N2O2/c1-3-11-19-12-10-16-8-9-17-15(18)14-6-4-13(2)5-7-14/h4-7,16H,3,8-12H2,1-2H3,(H,17,18)
InChIKeyJTSCXHMTRYLGPT-UHFFFAOYSA-N
XLogP1.74
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(butylamino)ethyl]-4-methylbenzamide
CID 54880787
N-[2-(2-ethylsulfanylethylamino)ethyl]-4-methylbenzamide
CID 104668564
methyl 3-[2-[(4-methylbenzoyl)amino]ethylamino]propanoate
CID 54880678
4-methyl-N-[2-(2-propylsulfonylethylamino)ethyl]benzamide
CID 106723308
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-4-methylbenzamide;ethane
CID 143583879
N-[2-(2-cyanoethylamino)ethyl]-4-methylbenzamide
CID 54880736
N-(2-acetamidoethyl)-4-methylbenzamide
CID 4186573
4-methyl-N-[2-(methylamino)ethyl]benzamide
CID 59535801
N-[2-[(2-ethyl-2-hydroxybutyl)amino]ethyl]-4-methylbenzamide
CID 114492846
N-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]-4-methylbenzamide
CID 161343746
N-[2-[(4-methoxybenzoyl)amino]ethyl]-4-methylbenzamide
CID 108537787
N-(2-aminooxyethyl)-4-methylbenzamide
CID 39239063

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide?
The IUPAC name of 4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide (CID 106451707) is 4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide.
What is the SMILES notation for 4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide?
The canonical SMILES for 4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide is CCCOCCNCCNC(=O)c1ccc(C)cc1.
What is the InChIKey of 4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide?
The InChIKey is JTSCXHMTRYLGPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-11-19-12-10-16-8-9-17-15(18)14-6-4-13(2)5-7-14/h4-7,16H,3,8-12H2,1-2H3,(H,17,18).
What are the key properties of 4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide?
4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide has a molecular weight of 264.37 g/mol, XLogP of 1.74, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[2-(2-propoxyethylamino)ethyl]benzamide is sourced from PubChem (CID 106451707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).