N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide

C16H22N2O2 — CID 6914795

IUPACN-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide
SMILESCC(=O)c1ccc(NC(=O)CN2CCCC(C)C2)cc1
InChIInChI=1S/C16H22N2O2/c1-12-4-3-9-18(10-12)11-16(20)17-15-7-5-14(6-8-15)13(2)19/h5-8,12H,3-4,9-11H2,1-2H3,(H,17,20)
InChIKeyYETMFMQJTSAUTL-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.56
Rot. Bonds4

About N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide

N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide (PubChem CID 6914795) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide
PubChem CID6914795
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide
SMILESCC(=O)c1ccc(NC(=O)CN2CCCC(C)C2)cc1
InChIInChI=1S/C16H22N2O2/c1-12-4-3-9-18(10-12)11-16(20)17-15-7-5-14(6-8-15)13(2)19/h5-8,12H,3-4,9-11H2,1-2H3,(H,17,20)
InChIKeyYETMFMQJTSAUTL-UHFFFAOYSA-N
XLogP2.56
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-aminophenyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 16779145
2-(3-methylpiperidin-1-yl)-N-pyridin-4-ylacetamide
CID 17066608
N-[4-(aminomethyl)phenyl]-2-(3-methylpiperidin-1-yl)acetamide
CID 16779543
2-(3-methylpiperidin-1-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 22197766
2-(3-methylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)acetamide
CID 109006515
2-(3-methylpiperidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide
CID 4824447
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-(3-methylpiperidin-1-yl)acetamide
CID 109006520
ethyl (3S)-1-[2-(4-acetylanilino)-2-oxoethyl]piperidine-3-carboxylate
CID 8533005
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-N-(4-acetylphenyl)acetamide
CID 171130359
N-(3-amino-4-methylphenyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 43375487
N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide
CID 1152741
N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide
CID 2681860

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide?
The IUPAC name of N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide (CID 6914795) is N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide?
The canonical SMILES for N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide is CC(=O)c1ccc(NC(=O)CN2CCCC(C)C2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide?
The InChIKey is YETMFMQJTSAUTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-12-4-3-9-18(10-12)11-16(20)17-15-7-5-14(6-8-15)13(2)19/h5-8,12H,3-4,9-11H2,1-2H3,(H,17,20).
What are the key properties of N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide?
N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide has a molecular weight of 274.36 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide is sourced from PubChem (CID 6914795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).