2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide

C16H22N2O2 — CID 8868826

IUPAC2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide
SMILESCc1ccccc1C(=O)NCCC(=O)N1CCCCC1
InChIInChI=1S/C16H22N2O2/c1-13-7-3-4-8-14(13)16(20)17-10-9-15(19)18-11-5-2-6-12-18/h3-4,7-8H,2,5-6,9-12H2,1H3,(H,17,20)
InChIKeyIYJLXVVTRXKPAY-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.13
Rot. Bonds4

About 2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide

2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide (PubChem CID 8868826) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide.

Molecular Properties

Compound Name2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide
PubChem CID8868826
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide
SMILESCc1ccccc1C(=O)NCCC(=O)N1CCCCC1
InChIInChI=1S/C16H22N2O2/c1-13-7-3-4-8-14(13)16(20)17-10-9-15(19)18-11-5-2-6-12-18/h3-4,7-8H,2,5-6,9-12H2,1H3,(H,17,20)
InChIKeyIYJLXVVTRXKPAY-UHFFFAOYSA-N
XLogP2.13
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-iodo-3-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide
CID 51118177
N-[3-(azepan-1-yl)-3-oxopropyl]-2,3-dihydroxy-4-methylbenzamide
CID 167804588
2-methyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)-5-sulfanylbenzamide
CID 107034729
N-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl]-2-methylbenzamide
CID 8967289
N-[3-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-3-oxopropyl]-2-methylbenzamide
CID 37016302
N-(3-oxo-3-piperidin-1-ylpropyl)benzamide
CID 17154515
N-[3-[4-(4-hydroxyphenyl)piperidin-1-yl]-3-oxopropyl]-2-methylbenzamide
CID 51327520
N-[3-[(3S)-3-[(2R,5S)-2,5-dimethylpyrrolidin-1-yl]piperidin-1-yl]-3-oxopropyl]-2-methylbenzamide
CID 52520619
N-[3-[(3S)-3-[(2R,5R)-2,5-dimethylpyrrolidin-1-yl]piperidin-1-yl]-3-oxopropyl]-2-methylbenzamide
CID 124815650
2-methyl-N-[3-[4-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-3-oxopropyl]benzamide
CID 55563545
2-methyl-N-[3-oxo-3-[4-(oxolan-2-ylmethyl)piperazin-1-yl]propyl]benzamide
CID 134012928
2-methyl-N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide
CID 46523795

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide?
The IUPAC name of 2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide (CID 8868826) is 2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide.
What is the SMILES notation for 2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide?
The canonical SMILES for 2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide is Cc1ccccc1C(=O)NCCC(=O)N1CCCCC1.
What is the InChIKey of 2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide?
The InChIKey is IYJLXVVTRXKPAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-13-7-3-4-8-14(13)16(20)17-10-9-15(19)18-11-5-2-6-12-18/h3-4,7-8H,2,5-6,9-12H2,1H3,(H,17,20).
What are the key properties of 2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide?
2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide has a molecular weight of 274.36 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(3-oxo-3-piperidin-1-ylpropyl)benzamide is sourced from PubChem (CID 8868826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).