2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide

C18H26N2O3 — CID 134049466

IUPAC2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide
SMILESCOCC(C)NC(=O)CN1CCC(C(=O)c2ccccc2)CC1
InChIInChI=1S/C18H26N2O3/c1-14(13-23-2)19-17(21)12-20-10-8-16(9-11-20)18(22)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,19,21)
InChIKeyYSEUMTPFNSJUHF-UHFFFAOYSA-N
MW318.42 g/mol
LogP1.73
Rot. Bonds7

About 2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide

2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide (PubChem CID 134049466) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is 2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide
PubChem CID134049466
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC Name2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide
SMILESCOCC(C)NC(=O)CN1CCC(C(=O)c2ccccc2)CC1
InChIInChI=1S/C18H26N2O3/c1-14(13-23-2)19-17(21)12-20-10-8-16(9-11-20)18(22)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,19,21)
InChIKeyYSEUMTPFNSJUHF-UHFFFAOYSA-N
XLogP1.73
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 ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2S)-1-methoxypropan-2-yl]-2-[4-[4-(2-methylpropyl)benzoyl]piperidin-1-yl]acetamide
CID 51946728
N-[(2S)-1-methoxypropan-2-yl]-2-pyrrolidin-1-ylacetamide
CID 94784934
methyl 1-[2-oxo-2-[[(2S)-4-phenylbutan-2-yl]amino]ethyl]piperidine-4-carboxylate
CID 8742230
2-(4-benzoylpiperidin-1-yl)-N-prop-2-ynylacetamide
CID 51322931
2-[4-(1-aminoethyl)piperidin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
CID 55261186
2-(4-benzoylpiperidin-1-yl)-N-benzylacetamide
CID 26037570
N-(1-methoxypropan-2-yl)-2-[4-[1-(methylamino)ethyl]piperidin-1-yl]acetamide
CID 63853257
2-(4-benzoylpiperidin-1-yl)-N-(2,2-dimethyl-1-thiophen-2-ylpropyl)acetamide
CID 60507562
N-butan-2-yl-2-[4-[2-(1-methoxypropan-2-ylamino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 134045413
2-[4-(2-amino-2-sulfanylideneethyl)piperazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
CID 63336209
N-(1-methoxypropan-2-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 51199549
2-[(3S)-3-aminopyrrolidin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
CID 81491720

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide?
The IUPAC name of 2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide (CID 134049466) is 2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide.
What is the SMILES notation for 2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide?
The canonical SMILES for 2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide is COCC(C)NC(=O)CN1CCC(C(=O)c2ccccc2)CC1.
What is the InChIKey of 2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide?
The InChIKey is YSEUMTPFNSJUHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-14(13-23-2)19-17(21)12-20-10-8-16(9-11-20)18(22)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,19,21).
What are the key properties of 2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide?
2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide has a molecular weight of 318.42 g/mol, XLogP of 1.73, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzoylpiperidin-1-yl)-N-(1-methoxypropan-2-yl)acetamide is sourced from PubChem (CID 134049466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).