2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride

C16H25ClN2O2 — CID 119473969

IUPAC2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride
SMILESCOc1ccc(CC(=O)NC(C)C2CCCNC2)cc1.Cl
InChIInChI=1S/C16H24N2O2.ClH/c1-12(14-4-3-9-17-11-14)18-16(19)10-13-5-7-15(20-2)8-6-13;/h5-8,12,14,17H,3-4,9-11H2,1-2H3,(H,18,19);1H
InChIKeyRHKVWIPKLCCRCU-UHFFFAOYSA-N
MW312.84 g/mol
LogP2.16
Rot. Bonds5

About 2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride

2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride (PubChem CID 119473969) has the molecular formula C16H25ClN2O2 and a molecular weight of 312.84 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride
PubChem CID119473969
Molecular FormulaC16H25ClN2O2
Molecular Weight312.84 g/mol
Exact Mass312.16
IUPAC Name2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride
SMILESCOc1ccc(CC(=O)NC(C)C2CCCNC2)cc1.Cl
InChIInChI=1S/C16H24N2O2.ClH/c1-12(14-4-3-9-17-11-14)18-16(19)10-13-5-7-15(20-2)8-6-13;/h5-8,12,14,17H,3-4,9-11H2,1-2H3,(H,18,19);1H
InChIKeyRHKVWIPKLCCRCU-UHFFFAOYSA-N
XLogP2.16
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.84
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride?
The IUPAC name of 2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride (CID 119473969) is 2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride?
The canonical SMILES for 2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride is COc1ccc(CC(=O)NC(C)C2CCCNC2)cc1.Cl.
What is the InChIKey of 2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride?
The InChIKey is RHKVWIPKLCCRCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2.ClH/c1-12(14-4-3-9-17-11-14)18-16(19)10-13-5-7-15(20-2)8-6-13;/h5-8,12,14,17H,3-4,9-11H2,1-2H3,(H,18,19);1H.
What are the key properties of 2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride?
2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride has a molecular weight of 312.84 g/mol, XLogP of 2.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-(1-piperidin-3-ylethyl)acetamide;hydrochloride is sourced from PubChem (CID 119473969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).