2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide

C17H27N3O — CID 81451615

IUPAC2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide
SMILESCCC1CN(CC(=O)NCCc2ccccc2)CCC1N
InChIInChI=1S/C17H27N3O/c1-2-15-12-20(11-9-16(15)18)13-17(21)19-10-8-14-6-4-3-5-7-14/h3-7,15-16H,2,8-13,18H2,1H3,(H,19,21)
InChIKeyMGLIJUDLXRHDKT-UHFFFAOYSA-N
MW289.42 g/mol
LogP1.40
Rot. Bonds6

About 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide

2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide (PubChem CID 81451615) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide
PubChem CID81451615
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC Name2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide
SMILESCCC1CN(CC(=O)NCCc2ccccc2)CCC1N
InChIInChI=1S/C17H27N3O/c1-2-15-12-20(11-9-16(15)18)13-17(21)19-10-8-14-6-4-3-5-7-14/h3-7,15-16H,2,8-13,18H2,1H3,(H,19,21)
InChIKeyMGLIJUDLXRHDKT-UHFFFAOYSA-N
XLogP1.40
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(aminomethyl)pyrrolidin-1-yl]-N-(2-phenylethyl)acetamide
CID 62063230
2-(4-amino-3-ethylpiperidin-1-yl)-N-[(4-fluorophenyl)methyl]acetamide
CID 81451256
2-(4-amino-3-ethylpiperidin-1-yl)-N-benzyl-N-methylacetamide
CID 81452559
2-(4-formylpiperidin-1-yl)-N-(2-phenylethyl)acetamide
CID 62656271
methyl 4-[[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]amino]butanoate
CID 81460156
2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylsulfanylphenyl)acetamide
CID 81452018
2-(4-amino-3-ethylpiperidin-1-yl)-N-(4-bromophenyl)acetamide
CID 81459153
N-[2-(4-methoxyphenyl)ethyl]-2-[(3R)-3-phenylpyrrolidin-1-yl]acetamide
CID 95313734
1-[2-oxo-2-(3-phenylpropylamino)ethyl]piperidine-4-carboxylic acid
CID 119908236
1-[2-[2-(4-chlorophenyl)ethylamino]-2-oxoethyl]pyrrolidine-3-carboxylic acid
CID 119905062
2-(2,6-dimethylmorpholin-4-yl)-N-(2-phenylethyl)acetamide;oxalic acid
CID 16807058
2-(3-methylpiperazin-1-yl)-N-(3-phenylpropyl)acetamide
CID 65449797

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide?
The IUPAC name of 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide (CID 81451615) is 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide.
What is the SMILES notation for 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide?
The canonical SMILES for 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide is CCC1CN(CC(=O)NCCc2ccccc2)CCC1N.
What is the InChIKey of 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide?
The InChIKey is MGLIJUDLXRHDKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-2-15-12-20(11-9-16(15)18)13-17(21)19-10-8-14-6-4-3-5-7-14/h3-7,15-16H,2,8-13,18H2,1H3,(H,19,21).
What are the key properties of 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide?
2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide has a molecular weight of 289.42 g/mol, XLogP of 1.40, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 81451615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).