2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide

C19H28N2O2 — CID 110246293

IUPAC2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide
SMILESCC(=O)N1CCC(CC(=O)N(C)CC(C)c2ccccc2)CC1
InChIInChI=1S/C19H28N2O2/c1-15(18-7-5-4-6-8-18)14-20(3)19(23)13-17-9-11-21(12-10-17)16(2)22/h4-8,15,17H,9-14H2,1-3H3
InChIKeySUULMYSMMPOBBL-UHFFFAOYSA-N
MW316.44 g/mol
LogP2.90
Rot. Bonds5

About 2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide

2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide (PubChem CID 110246293) has the molecular formula C19H28N2O2 and a molecular weight of 316.44 g/mol. Its IUPAC name is 2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide
PubChem CID110246293
Molecular FormulaC19H28N2O2
Molecular Weight316.44 g/mol
Exact Mass316.22
IUPAC Name2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide
SMILESCC(=O)N1CCC(CC(=O)N(C)CC(C)c2ccccc2)CC1
InChIInChI=1S/C19H28N2O2/c1-15(18-7-5-4-6-8-18)14-20(3)19(23)13-17-9-11-21(12-10-17)16(2)22/h4-8,15,17H,9-14H2,1-3H3
InChIKeySUULMYSMMPOBBL-UHFFFAOYSA-N
XLogP2.90
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-N-methyl-N-(2-phenylpropyl)acetamide
CID 110246294
1-[4-(1-phenylethylamino)piperidin-1-yl]ethanone
CID 43222563
1-(4-aminopiperidin-1-yl)-3-phenylbutan-1-one
CID 72638559
N-methyl-N-(2-phenylpropyl)but-3-enamide
CID 143446604
N-methyl-2-(methylsulfamoyl)-N-(2-phenylpropyl)acetamide
CID 71974926
1-[4-(1-phenylbutylamino)piperidin-1-yl]ethanone
CID 43224633
ethane;1-[4-[[methyl(1-phenylpropan-2-yl)amino]methyl]piperidin-1-yl]ethanone
CID 90770756
(3S)-1-[(3R)-3-hydroxypyrrolidin-1-yl]-3-phenylbutan-1-one
CID 129471018
(2R)-N,N-dimethyl-2-phenylpropan-1-amine
CID 59474206
N-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-N-(1-phenylethyl)acetamide
CID 113118967
2-[1-[3-(4-fluorophenyl)butanoyl]piperidin-4-yl]acetic acid
CID 119178715
N-methyl-N-(2-phenylpropyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119316587

Frequently Asked Questions

What is the IUPAC name of 2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide?
The IUPAC name of 2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide (CID 110246293) is 2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide.
What is the SMILES notation for 2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide?
The canonical SMILES for 2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide is CC(=O)N1CCC(CC(=O)N(C)CC(C)c2ccccc2)CC1.
What is the InChIKey of 2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide?
The InChIKey is SUULMYSMMPOBBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-15(18-7-5-4-6-8-18)14-20(3)19(23)13-17-9-11-21(12-10-17)16(2)22/h4-8,15,17H,9-14H2,1-3H3.
What are the key properties of 2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide?
2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide has a molecular weight of 316.44 g/mol, XLogP of 2.90, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-acetylpiperidin-4-yl)-N-methyl-N-(2-phenylpropyl)acetamide is sourced from PubChem (CID 110246293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).