2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide

C16H24N2O — CID 50875448

IUPAC2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide
SMILESCN1CCC(CC(=O)NCCc2ccccc2)CC1
InChIInChI=1S/C16H24N2O/c1-18-11-8-15(9-12-18)13-16(19)17-10-7-14-5-3-2-4-6-14/h2-6,15H,7-13H2,1H3,(H,17,19)
InChIKeyHYYOOIKKDXFOCR-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.08
Rot. Bonds5

About 2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide

2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide (PubChem CID 50875448) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide
PubChem CID50875448
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide
SMILESCN1CCC(CC(=O)NCCc2ccccc2)CC1
InChIInChI=1S/C16H24N2O/c1-18-11-8-15(9-12-18)13-16(19)17-10-7-14-5-3-2-4-6-14/h2-6,15H,7-13H2,1H3,(H,17,19)
InChIKeyHYYOOIKKDXFOCR-UHFFFAOYSA-N
XLogP2.08
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-[(1-methylpiperidin-4-yl)methyl]-N-(2-phenylethyl)oxamide
CID 16886539
N-(3-benzylsulfanylpropyl)-2-(1-methylpiperidin-4-yl)acetamide
CID 50875423
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-phenylacetamide
CID 50875243
1-(1-methylpiperidin-4-yl)-3-(2-phenylethyl)urea
CID 11499904
3-(4-methylpiperazin-1-yl)-3-oxo-N-(2-phenylethyl)propanamide
CID 108944340
N'-methyl-N'-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)oxamide
CID 108505781
2-cyclohexyl-N-(3-phenylpropyl)acetamide
CID 59168672
N-[(2-methylphenyl)methyl]-2-(1-methylpiperidin-4-yl)acetamide
CID 95969501
N-(2-phenylethyl)-2-piperidin-3-ylacetamide
CID 62690707
N-methyl-2-[1-(3-phenylpropyl)piperidin-4-yl]acetamide
CID 142597068
N-(3-phenylpropyl)-2-piperidin-4-ylacetamide
CID 60905850
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-phenoxyacetamide
CID 50875305

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide?
The IUPAC name of 2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide (CID 50875448) is 2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide.
What is the SMILES notation for 2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide?
The canonical SMILES for 2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide is CN1CCC(CC(=O)NCCc2ccccc2)CC1.
What is the InChIKey of 2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide?
The InChIKey is HYYOOIKKDXFOCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-18-11-8-15(9-12-18)13-16(19)17-10-7-14-5-3-2-4-6-14/h2-6,15H,7-13H2,1H3,(H,17,19).
What are the key properties of 2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide?
2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide has a molecular weight of 260.38 g/mol, XLogP of 2.08, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpiperidin-4-yl)-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 50875448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).