2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide

C16H24N2O2 — CID 104547635

IUPAC2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide
SMILESCNCCc1ccccc1C(=O)NCCC1CCCO1
InChIInChI=1S/C16H24N2O2/c1-17-10-8-13-5-2-3-7-15(13)16(19)18-11-9-14-6-4-12-20-14/h2-3,5,7,14,17H,4,6,8-12H2,1H3,(H,18,19)
InChIKeyWDLVKBQDPRQPMF-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.75
Rot. Bonds7

About 2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide

2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide (PubChem CID 104547635) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide.

Molecular Properties

Compound Name2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide
PubChem CID104547635
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide
SMILESCNCCc1ccccc1C(=O)NCCC1CCCO1
InChIInChI=1S/C16H24N2O2/c1-17-10-8-13-5-2-3-7-15(13)16(19)18-11-9-14-6-4-12-20-14/h2-3,5,7,14,17H,4,6,8-12H2,1H3,(H,18,19)
InChIKeyWDLVKBQDPRQPMF-UHFFFAOYSA-N
XLogP1.75
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

oxolan-2-ylmethyl 2-[2-(methylamino)ethyl]benzoate
CID 104548522
2-iodo-N-[2-(oxan-2-yl)ethyl]benzamide
CID 103993683
2-[2-[3-(oxolan-2-yl)propylamino]ethyl]benzoic acid
CID 104546797
N-(cyclohexylmethyl)-2-[2-(methylamino)ethyl]benzamide
CID 104547420
N-(2,2-dicyclopropylethyl)-2-[2-(methylamino)ethyl]benzamide
CID 104548036
3-[[2-[2-(methylamino)ethyl]benzoyl]amino]propanoic acid
CID 71070439
2-methyl-N-[2-[(2S)-oxolan-2-yl]ethyl]-6-phenylpyridine-3-carboxamide
CID 97002216
2-[2-(oxan-2-ylmethylamino)ethyl]benzoic acid
CID 113425613
methyl 3-[2-(oxolan-2-yl)ethylcarbamoyl]benzoate
CID 51086480
N-[2-(2-methylphenyl)ethyl]-2-(oxolan-2-yl)ethanamine
CID 79763588
(2S)-2-amino-N-[2-(oxolan-2-yl)ethyl]-4-phenylbutanamide
CID 104984102
3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide
CID 55164039

Frequently Asked Questions

What is the IUPAC name of 2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide?
The IUPAC name of 2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide (CID 104547635) is 2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide.
What is the SMILES notation for 2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide?
The canonical SMILES for 2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide is CNCCc1ccccc1C(=O)NCCC1CCCO1.
What is the InChIKey of 2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide?
The InChIKey is WDLVKBQDPRQPMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-17-10-8-13-5-2-3-7-15(13)16(19)18-11-9-14-6-4-12-20-14/h2-3,5,7,14,17H,4,6,8-12H2,1H3,(H,18,19).
What are the key properties of 2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide?
2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide has a molecular weight of 276.38 g/mol, XLogP of 1.75, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide is sourced from PubChem (CID 104547635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).