2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide

C19H28N2O — CID 78719824

IUPAC2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide
SMILESCC(NC(=O)CN1CCC(Cc2ccccc2)CC1)C1CC1
InChIInChI=1S/C19H28N2O/c1-15(18-7-8-18)20-19(22)14-21-11-9-17(10-12-21)13-16-5-3-2-4-6-16/h2-6,15,17-18H,7-14H2,1H3,(H,20,22)
InChIKeySGHROPZIEHTCID-UHFFFAOYSA-N
MW300.45 g/mol
LogP2.86
Rot. Bonds6

About 2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide

2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide (PubChem CID 78719824) has the molecular formula C19H28N2O and a molecular weight of 300.45 g/mol. Its IUPAC name is 2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide.

Molecular Properties

Compound Name2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide
PubChem CID78719824
Molecular FormulaC19H28N2O
Molecular Weight300.45 g/mol
Exact Mass300.22
IUPAC Name2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide
SMILESCC(NC(=O)CN1CCC(Cc2ccccc2)CC1)C1CC1
InChIInChI=1S/C19H28N2O/c1-15(18-7-8-18)20-19(22)14-21-11-9-17(10-12-21)13-16-5-3-2-4-6-16/h2-6,15,17-18H,7-14H2,1H3,(H,20,22)
InChIKeySGHROPZIEHTCID-UHFFFAOYSA-N
XLogP2.86
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.45
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-benzylpiperidin-1-yl)-N-[(1S)-1-(furan-2-yl)ethyl]acetamide
CID 9430556
2-(4-benzylpiperidin-1-yl)-N-(1-thiophen-2-ylethyl)acetamide
CID 16566117
N-[(1R)-1-cyclopropylethyl]-2-[(3R)-3-phenylpyrrolidin-1-yl]acetamide
CID 95321250
N-[(1R)-1-cyclopropylethyl]-2-[4-[(2S)-2-hydroxy-2-phenylethyl]piperazin-1-yl]acetamide
CID 95333663
N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-(4-benzylpiperidin-1-yl)acetamide
CID 8904535
2-(4-benzylpiperidin-1-yl)-N-(2-methoxyethyl)acetamide
CID 42851078
2-(4-benzylpiperidin-1-yl)-N-(4-ethylphenyl)acetamide
CID 17380707
2-(4-benzylpiperidin-1-yl)acetamide
CID 6465422
N-[(1R)-1-cyclopropylethyl]-2-[4-[2-(2-methylphenyl)acetyl]piperazin-1-yl]acetamide
CID 95383065
2-[4-[2-[[(1S)-1-cyclopropylethyl]amino]-2-oxoethyl]piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide
CID 8917657
3-(4-benzylpiperidin-1-yl)-2-methylpropanoic acid
CID 43538761
dilithium bis(2-(4-benzylpiperidin-1-yl)acetate)
CID 162364859

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide?
The IUPAC name of 2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide (CID 78719824) is 2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide.
What is the SMILES notation for 2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide?
The canonical SMILES for 2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide is CC(NC(=O)CN1CCC(Cc2ccccc2)CC1)C1CC1.
What is the InChIKey of 2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide?
The InChIKey is SGHROPZIEHTCID-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O/c1-15(18-7-8-18)20-19(22)14-21-11-9-17(10-12-21)13-16-5-3-2-4-6-16/h2-6,15,17-18H,7-14H2,1H3,(H,20,22).
What are the key properties of 2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide?
2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide has a molecular weight of 300.45 g/mol, XLogP of 2.86, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzylpiperidin-1-yl)-N-(1-cyclopropylethyl)acetamide is sourced from PubChem (CID 78719824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).