N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide

C13H20N2O2 — CID 113425674

IUPACN-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide
SMILESCNCCc1ccccc1C(=O)N(C)CCO
InChIInChI=1S/C13H20N2O2/c1-14-8-7-11-5-3-4-6-12(11)13(17)15(2)9-10-16/h3-6,14,16H,7-10H2,1-2H3
InChIKeyKKXMGQUYKBFWFF-UHFFFAOYSA-N
MW236.31 g/mol
LogP0.51
Rot. Bonds6

About N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide

N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide (PubChem CID 113425674) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide
PubChem CID113425674
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide
SMILESCNCCc1ccccc1C(=O)N(C)CCO
InChIInChI=1S/C13H20N2O2/c1-14-8-7-11-5-3-4-6-12(11)13(17)15(2)9-10-16/h3-6,14,16H,7-10H2,1-2H3
InChIKeyKKXMGQUYKBFWFF-UHFFFAOYSA-N
XLogP0.51
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[2-(methylamino)ethyl]-N-[3-(methylamino)propyl]benzamide
CID 104548124
N-methyl-N,2-bis[2-(methylamino)ethyl]benzamide
CID 104547950
N-methyl-2-[2-(methylamino)ethyl]-N-(2-methylsulfanylethyl)benzamide
CID 113425695
N-ethyl-N-(2-hydroxyethyl)-2-[2-(methylamino)ethyl]benzamide
CID 104547574
1-N,2-N-bis(2-hydroxyethyl)-1-N,2-N-dimethylbenzene-1,2-dicarboxamide
CID 54303134
N-methyl-2-[2-(methylamino)ethyl]-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 104547877
N-methoxy-N-methyl-2-[2-(methylamino)ethyl]benzamide
CID 104547715
N,N-diethyl-2-[2-(methylamino)ethyl]benzamide
CID 104547231
2,2-dimethyl-1-[2-[2-(methylamino)ethyl]phenyl]propan-1-one
CID 116613271
N-methyl-2-[2-(methylamino)ethyl]-N-[(2-methylfuran-3-yl)methyl]benzamide
CID 104547733
2-[2-(methylamino)ethyl]benzamide
CID 69094527
2-[methyl-[2-[2-(methylamino)ethyl]benzoyl]amino]propanoic acid
CID 104547839

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide?
The IUPAC name of N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide (CID 113425674) is N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide is CNCCc1ccccc1C(=O)N(C)CCO.
What is the InChIKey of N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide?
The InChIKey is KKXMGQUYKBFWFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-14-8-7-11-5-3-4-6-12(11)13(17)15(2)9-10-16/h3-6,14,16H,7-10H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide?
N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide has a molecular weight of 236.31 g/mol, XLogP of 0.51, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide is sourced from PubChem (CID 113425674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).