N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide

C14H20N2O3 — CID 79381250

IUPACN-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide
SMILESCN(CC(C)(C)O)C(=O)CNC(=O)c1ccccc1
InChIInChI=1S/C14H20N2O3/c1-14(2,19)10-16(3)12(17)9-15-13(18)11-7-5-4-6-8-11/h4-8,19H,9-10H2,1-3H3,(H,15,18)
InChIKeyNPNUFTPKEZWDGN-UHFFFAOYSA-N
MW264.32 g/mol
LogP0.65
Rot. Bonds5

About N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide

N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide (PubChem CID 79381250) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide
PubChem CID79381250
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide
SMILESCN(CC(C)(C)O)C(=O)CNC(=O)c1ccccc1
InChIInChI=1S/C14H20N2O3/c1-14(2,19)10-16(3)12(17)9-15-13(18)11-7-5-4-6-8-11/h4-8,19H,9-10H2,1-3H3,(H,15,18)
InChIKeyNPNUFTPKEZWDGN-UHFFFAOYSA-N
XLogP0.65
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide
CID 79380984
N-(2-hydroxy-2-methylpropyl)-N-methylbenzamide
CID 13214665
N-[2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-2-oxoethyl]benzamide
CID 103839771
N-[2-(N-methylanilino)-2-oxoethyl]benzamide
CID 12674158
4-[[2-[ethyl(methyl)amino]-2-oxoethyl]carbamoyl]benzoic acid
CID 114134240
(2-hydroxy-2-methylpropyl) 2-benzamidoacetate
CID 134970204
N-[2-[butyl(methyl)amino]-2-oxoethyl]benzamide;methylboronic acid
CID 143334744
N-[2-[azetidin-3-yl(methyl)amino]-2-oxoethyl]benzamide
CID 66185921
N-[2-[methyl(pyridin-3-ylmethyl)amino]-2-oxoethyl]benzamide
CID 110743929
3-bromo-N-[2-[methyl(2,2,2-trifluoroethyl)amino]-2-oxoethyl]benzamide
CID 52599948
N-[2-[methyl(quinolin-5-ylmethyl)amino]-2-oxoethyl]benzamide
CID 70751619
N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
CID 111698223

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide?
The IUPAC name of N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide (CID 79381250) is N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide is CN(CC(C)(C)O)C(=O)CNC(=O)c1ccccc1.
What is the InChIKey of N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide?
The InChIKey is NPNUFTPKEZWDGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-14(2,19)10-16(3)12(17)9-15-13(18)11-7-5-4-6-8-11/h4-8,19H,9-10H2,1-3H3,(H,15,18).
What are the key properties of N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide?
N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide has a molecular weight of 264.32 g/mol, XLogP of 0.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-hydroxy-2-methylpropyl)-methylamino]-2-oxoethyl]benzamide is sourced from PubChem (CID 79381250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).