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

C17H27N3O — CID 79322682

IUPAC2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide
SMILESCC(C)C(NC(=O)CN1CCC(N)CC1)c1ccccc1
InChIInChI=1S/C17H27N3O/c1-13(2)17(14-6-4-3-5-7-14)19-16(21)12-20-10-8-15(18)9-11-20/h3-7,13,15,17H,8-12,18H2,1-2H3,(H,19,21)
InChIKeyNHGVBNOGCMERLY-UHFFFAOYSA-N
MW289.42 g/mol
LogP1.92
Rot. Bonds5

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

2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide (PubChem CID 79322682) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide
PubChem CID79322682
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide
SMILESCC(C)C(NC(=O)CN1CCC(N)CC1)c1ccccc1
InChIInChI=1S/C17H27N3O/c1-13(2)17(14-6-4-3-5-7-14)19-16(21)12-20-10-8-15(18)9-11-20/h3-7,13,15,17H,8-12,18H2,1-2H3,(H,19,21)
InChIKeyNHGVBNOGCMERLY-UHFFFAOYSA-N
XLogP1.92
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-aminopiperidin-1-yl)-N-(1-phenylethyl)acetamide
CID 43556855
N-(2-methyl-1-phenylpropyl)-2-(4-phenylpiperazin-1-yl)acetamide
CID 51284732
2-(4-aminopiperidin-1-yl)-N-(1-phenylbutyl)acetamide
CID 79322712
ethyl 4-[2-[(2-methyl-1-phenylpropyl)amino]-2-oxoethyl]piperazine-1-carboxylate
CID 46665939
2-(4-aminopiperidin-1-yl)-N-[(1S)-1-(3-chlorophenyl)ethyl]acetamide
CID 81371581
2-(4-aminopiperidin-1-yl)-N-[1-(furan-2-yl)ethyl]acetamide
CID 43556867
2-(4-benzhydrylpiperidin-1-yl)-N-propan-2-ylacetamide
CID 59104361
2-[4-[cyclohexyl(methyl)sulfamoyl]piperazin-1-yl]-N-(2-methyl-1-phenylpropyl)acetamide
CID 55625884
2-(4-aminopiperidin-1-yl)-N-[(1R)-1-(4-chlorophenyl)ethyl]acetamide
CID 81353847
2-(4-aminopiperidin-1-yl)-N-[1-(4-chlorophenyl)ethyl]acetamide
CID 79328175
2-(4-hydroxypiperidin-1-yl)-N-[(1R)-1-(4-methoxyphenyl)-2-methylpropyl]acetamide
CID 41335963
2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-[(1S)-2-methyl-1-phenylpropyl]acetamide
CID 41367420

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide (CID 79322682) is 2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide is CC(C)C(NC(=O)CN1CCC(N)CC1)c1ccccc1.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide?
The InChIKey is NHGVBNOGCMERLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-13(2)17(14-6-4-3-5-7-14)19-16(21)12-20-10-8-15(18)9-11-20/h3-7,13,15,17H,8-12,18H2,1-2H3,(H,19,21).
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide?
2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide has a molecular weight of 289.42 g/mol, XLogP of 1.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-N-(2-methyl-1-phenylpropyl)acetamide is sourced from PubChem (CID 79322682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).