N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide

C13H18N2O2 — CID 60636554

IUPACN-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
SMILESCCCNC(=O)CN(C)C(=O)c1ccccc1
InChIInChI=1S/C13H18N2O2/c1-3-9-14-12(16)10-15(2)13(17)11-7-5-4-6-8-11/h4-8H,3,9-10H2,1-2H3,(H,14,16)
InChIKeyCOCXRSLGAYSXMI-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.28
Rot. Bonds5

About N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide

N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide (PubChem CID 60636554) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide.

Molecular Properties

Compound NameN-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
PubChem CID60636554
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
SMILESCCCNC(=O)CN(C)C(=O)c1ccccc1
InChIInChI=1S/C13H18N2O2/c1-3-9-14-12(16)10-15(2)13(17)11-7-5-4-6-8-11/h4-8H,3,9-10H2,1-2H3,(H,14,16)
InChIKeyCOCXRSLGAYSXMI-UHFFFAOYSA-N
XLogP1.28
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-iodo-N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 47097429
3-iodo-N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 7972299
N-methyl-4-nitro-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 7780191
3,5-diamino-N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 61115445
phenyl N-methyl-N-[2-oxo-2-(propylamino)ethyl]carbamate
CID 60636579
ethyl 2-[[2-[benzoyl(methyl)amino]acetyl]amino]acetate
CID 47257628
N-[2-[(5-hydroxy-4-methylpentyl)amino]-2-oxoethyl]-N-methylbenzamide
CID 103862344
3-[[2-[benzoyl(methyl)amino]acetyl]amino]-2,2-dimethylpropanoic acid
CID 115427325
(E)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]-3-phenylprop-2-enamide
CID 7972275
4-(1,3-dithiolan-2-yl)-N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 7972240
3-hydroxy-4-iodo-N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 104627430
N-[2-[(3-amino-2-hydroxy-3-oxopropyl)amino]-2-oxoethyl]-N-methylbenzamide
CID 106164142

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide?
The IUPAC name of N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide (CID 60636554) is N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide.
What is the SMILES notation for N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide?
The canonical SMILES for N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide is CCCNC(=O)CN(C)C(=O)c1ccccc1.
What is the InChIKey of N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide?
The InChIKey is COCXRSLGAYSXMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-3-9-14-12(16)10-15(2)13(17)11-7-5-4-6-8-11/h4-8H,3,9-10H2,1-2H3,(H,14,16).
What are the key properties of N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide?
N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide has a molecular weight of 234.30 g/mol, XLogP of 1.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-oxo-2-(propylamino)ethyl]benzamide is sourced from PubChem (CID 60636554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).