2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide

C18H26N2O3 — CID 124758814

IUPAC2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide
SMILESCOCCN1CCC[C@H](CNC(=O)c2ccccc2C(C)=O)C1
InChIInChI=1S/C18H26N2O3/c1-14(21)16-7-3-4-8-17(16)18(22)19-12-15-6-5-9-20(13-15)10-11-23-2/h3-4,7-8,15H,5-6,9-13H2,1-2H3,(H,19,22)/t15-/m1/s1
InChIKeyZRFVFUFPACKITP-OAHLLOKOSA-N
MW318.42 g/mol
LogP1.98
Rot. Bonds7

About 2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide

2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide (PubChem CID 124758814) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is 2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide.

Molecular Properties

Compound Name2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide
PubChem CID124758814
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC Name2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide
SMILESCOCCN1CCC[C@H](CNC(=O)c2ccccc2C(C)=O)C1
InChIInChI=1S/C18H26N2O3/c1-14(21)16-7-3-4-8-17(16)18(22)19-12-15-6-5-9-20(13-15)10-11-23-2/h3-4,7-8,15H,5-6,9-13H2,1-2H3,(H,19,22)/t15-/m1/s1
InChIKeyZRFVFUFPACKITP-OAHLLOKOSA-N
XLogP1.98
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-2-(methoxymethyl)benzamide
CID 95238690
4-fluoro-2-hydroxy-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide
CID 125166360
4-benzyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]piperidine-1-carboxamide
CID 126433119
N-[[(3S)-1-(2-methoxyethyl)piperidin-3-yl]methyl]-3-(4-methylphenyl)benzamide
CID 125176783
1-(4-chloronaphthalen-1-yl)-3-[[1-(2-methoxyethyl)piperidin-3-yl]methyl]urea
CID 72913939
N-[[(3S)-1-(2-methoxyethyl)piperidin-3-yl]methyl]-1H-imidazole-5-carboxamide
CID 125177932
1-[2-[2-(3-ethylpiperidin-1-yl)ethoxy]phenyl]ethanone
CID 43433400
N-[[(3R)-1-(3-methylsulfanylpropyl)piperidin-3-yl]methyl]naphthalene-1-carboxamide
CID 25458195
4-bromo-N-[[(3S)-1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]benzamide
CID 95238744
N-[[(3R)-1-methylpiperidin-3-yl]methyl]-2-propoxybenzamide
CID 95210574
2-methoxy-N-[[(3R)-1-(pyridin-4-ylmethyl)piperidin-3-yl]methyl]benzamide
CID 95222271
2-fluoro-N-[[1-[1-(2-methoxyethyl)pyrrolidine-3-carbonyl]piperidin-4-yl]methyl]benzamide
CID 131936819

Frequently Asked Questions

What is the IUPAC name of 2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide?
The IUPAC name of 2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide (CID 124758814) is 2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide.
What is the SMILES notation for 2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide?
The canonical SMILES for 2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide is COCCN1CCC[C@H](CNC(=O)c2ccccc2C(C)=O)C1.
What is the InChIKey of 2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide?
The InChIKey is ZRFVFUFPACKITP-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-14(21)16-7-3-4-8-17(16)18(22)19-12-15-6-5-9-20(13-15)10-11-23-2/h3-4,7-8,15H,5-6,9-13H2,1-2H3,(H,19,22)/t15-/m1/s1.
What are the key properties of 2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide?
2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide has a molecular weight of 318.42 g/mol, XLogP of 1.98, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetyl-N-[[(3R)-1-(2-methoxyethyl)piperidin-3-yl]methyl]benzamide is sourced from PubChem (CID 124758814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).