N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide

C16H24N2O2 — CID 104547501

IUPACN-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide
SMILESCNCCc1ccccc1C(=O)N(C)C1CCOCC1
InChIInChI=1S/C16H24N2O2/c1-17-10-7-13-5-3-4-6-15(13)16(19)18(2)14-8-11-20-12-9-14/h3-6,14,17H,7-12H2,1-2H3
InChIKeyFDUMVSULDJYKPI-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.70
Rot. Bonds5

About N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide

N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide (PubChem CID 104547501) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide.

Molecular Properties

Compound NameN-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide
PubChem CID104547501
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide
SMILESCNCCc1ccccc1C(=O)N(C)C1CCOCC1
InChIInChI=1S/C16H24N2O2/c1-17-10-7-13-5-3-4-6-15(13)16(19)18(2)14-8-11-20-12-9-14/h3-6,14,17H,7-12H2,1-2H3
InChIKeyFDUMVSULDJYKPI-UHFFFAOYSA-N
XLogP1.70
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[2-(methylamino)ethyl]-N-(1-methylpiperidin-4-yl)benzamide
CID 104547292
[2-[2-(methylamino)ethyl]phenyl]-(oxan-4-yl)methanone
CID 116613219
2-amino-N-methyl-N-(oxan-4-yl)benzamide
CID 43610601
N-methyl-N,2-bis[2-(methylamino)ethyl]benzamide
CID 104547950
N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide
CID 104547771
N-methoxy-N-methyl-2-[2-(methylamino)ethyl]benzamide
CID 104547715
2-[(dimethylamino)methyl]-N-[4-[methyl(oxan-4-yl)carbamoyl]phenyl]benzamide
CID 126803901
N,N-diethyl-2-[2-(methylamino)ethyl]benzamide
CID 104547231
N-methyl-2-[2-(methylamino)ethyl]-N-[3-(methylamino)propyl]benzamide
CID 104548124
N-(2-hydroxyethyl)-N-methyl-2-[2-(methylamino)ethyl]benzamide
CID 113425674
3-amino-2-hydroxy-N-methyl-N-(oxan-4-yl)benzamide
CID 113386399
2-bromo-N-methyl-N-(oxolan-3-yl)benzamide
CID 78954018

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide?
The IUPAC name of N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide (CID 104547501) is N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide.
What is the SMILES notation for N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide?
The canonical SMILES for N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide is CNCCc1ccccc1C(=O)N(C)C1CCOCC1.
What is the InChIKey of N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide?
The InChIKey is FDUMVSULDJYKPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-17-10-7-13-5-3-4-6-15(13)16(19)18(2)14-8-11-20-12-9-14/h3-6,14,17H,7-12H2,1-2H3.
What are the key properties of N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide?
N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide has a molecular weight of 276.38 g/mol, XLogP of 1.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide is sourced from PubChem (CID 104547501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).