N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide

C15H20N2O3 — CID 78956835

IUPACN-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide
SMILESCN(CC(=O)NCC1(C)COC1)C(=O)c1ccccc1
InChIInChI=1S/C15H20N2O3/c1-15(10-20-11-15)9-16-13(18)8-17(2)14(19)12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H,16,18)
InChIKeyVABHNZVMNPMMEX-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.91
Rot. Bonds5

About N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide

N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide (PubChem CID 78956835) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide
PubChem CID78956835
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide
SMILESCN(CC(=O)NCC1(C)COC1)C(=O)c1ccccc1
InChIInChI=1S/C15H20N2O3/c1-15(10-20-11-15)9-16-13(18)8-17(2)14(19)12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H,16,18)
InChIKeyVABHNZVMNPMMEX-UHFFFAOYSA-N
XLogP0.91
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 115449986
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CID 60636554
N-[2-[[1-(hydroxymethyl)cyclopropyl]amino]-2-oxoethyl]-N-methylbenzamide
CID 115877489
4-benzyl-N-methyl-N-[(3-methyloxetan-3-yl)methyl]benzamide
CID 101031048
N-[5-[benzoyl(methyl)amino]-2,4-bis(sulfanylidene)pentyl]-N-methylbenzamide
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2-[(4-benzoylbenzoyl)-methylamino]acetic acid
CID 175926821
3-[[2-[benzoyl(methyl)amino]acetyl]amino]-2,2-dimethylpropanoic acid
CID 115427325
N-[2-[[1-(hydroxymethyl)cyclopentyl]amino]-2-oxoethyl]-N-methylbenzamide
CID 62518984
N-benzyl-N-[(3-methyloxetan-3-yl)methyl]benzamide
CID 11119991
N-[2-[(3-amino-2-hydroxy-3-oxopropyl)amino]-2-oxoethyl]-N-methylbenzamide
CID 106164142
ethyl 2-[[2-[benzoyl(methyl)amino]acetyl]amino]acetate
CID 47257628
2-(4-fluorophenyl)-N-[(3-methyloxetan-3-yl)methyl]acetamide
CID 78957558

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide?
The IUPAC name of N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide (CID 78956835) is N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide.
What is the SMILES notation for N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide?
The canonical SMILES for N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide is CN(CC(=O)NCC1(C)COC1)C(=O)c1ccccc1.
What is the InChIKey of N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide?
The InChIKey is VABHNZVMNPMMEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-15(10-20-11-15)9-16-13(18)8-17(2)14(19)12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3,(H,16,18).
What are the key properties of N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide?
N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide has a molecular weight of 276.34 g/mol, XLogP of 0.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-[(3-methyloxetan-3-yl)methylamino]-2-oxoethyl]benzamide is sourced from PubChem (CID 78956835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).