2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide

C17H26N2O2 — CID 82732420

IUPAC2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC1NCCCC1CC
InChIInChI=1S/C17H26N2O2/c1-3-13-8-7-11-18-15(13)12-19-17(20)14-9-5-6-10-16(14)21-4-2/h5-6,9-10,13,15,18H,3-4,7-8,11-12H2,1-2H3,(H,19,20)
InChIKeyLMMMRXSHUGOTOA-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.59
Rot. Bonds6

About 2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide

2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide (PubChem CID 82732420) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide.

Molecular Properties

Compound Name2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide
PubChem CID82732420
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC1NCCCC1CC
InChIInChI=1S/C17H26N2O2/c1-3-13-8-7-11-18-15(13)12-19-17(20)14-9-5-6-10-16(14)21-4-2/h5-6,9-10,13,15,18H,3-4,7-8,11-12H2,1-2H3,(H,19,20)
InChIKeyLMMMRXSHUGOTOA-UHFFFAOYSA-N
XLogP2.59
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-3-methoxybenzamide
CID 82732402
N-[(2-bromocyclopentyl)methyl]-2-ethoxybenzamide
CID 113275455
2-methoxy-N-[(3-methylpiperidin-2-yl)methyl]benzamide
CID 63304743
2-(2-ethoxyethoxy)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 119513373
N-[(3-ethylpiperidin-2-yl)methyl]-2-fluoro-6-hydroxybenzamide
CID 107014745
N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-4-methoxybenzamide
CID 82732421
N-[(3-ethylpiperidin-2-yl)methyl]-3-methoxy-4-methylbenzamide
CID 82731476
N-[(3-ethylpiperidin-2-yl)methyl]-2-hydroxy-5-methoxybenzamide
CID 82731920
2-ethoxy-N-[[(2R)-oxiran-2-yl]methyl]benzamide
CID 97180721
N-[(3-ethylpiperidin-2-yl)methyl]-3-fluoro-4-methoxybenzamide
CID 82732425
N-[[1-(cyclohexylmethyl)piperidin-4-yl]methyl]-2-ethoxybenzamide
CID 3232201
2-ethoxy-N-[[(3R)-thiolan-3-yl]methyl]benzamide
CID 125139619

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide?
The IUPAC name of 2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide (CID 82732420) is 2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide.
What is the SMILES notation for 2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide?
The canonical SMILES for 2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide is CCOc1ccccc1C(=O)NCC1NCCCC1CC.
What is the InChIKey of 2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide?
The InChIKey is LMMMRXSHUGOTOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-3-13-8-7-11-18-15(13)12-19-17(20)14-9-5-6-10-16(14)21-4-2/h5-6,9-10,13,15,18H,3-4,7-8,11-12H2,1-2H3,(H,19,20).
What are the key properties of 2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide?
2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide has a molecular weight of 290.41 g/mol, XLogP of 2.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[(3-ethylpiperidin-2-yl)methyl]benzamide is sourced from PubChem (CID 82732420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).