3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride

C16H24Cl2N2O2 — CID 119555737

IUPAC3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
SMILESCl.O=C(CCOc1ccc(Cl)cc1)NCCC1CCCNC1
InChIInChI=1S/C16H23ClN2O2.ClH/c17-14-3-5-15(6-4-14)21-11-8-16(20)19-10-7-13-2-1-9-18-12-13;/h3-6,13,18H,1-2,7-12H2,(H,19,20);1H
InChIKeyVXIFKNSPMAXENM-UHFFFAOYSA-N
MW347.29 g/mol
LogP3.04
Rot. Bonds7

About 3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride

3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride (PubChem CID 119555737) has the molecular formula C16H24Cl2N2O2 and a molecular weight of 347.29 g/mol. Its IUPAC name is 3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride.

Molecular Properties

Compound Name3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
PubChem CID119555737
Molecular FormulaC16H24Cl2N2O2
Molecular Weight347.29 g/mol
Exact Mass346.12
IUPAC Name3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
SMILESCl.O=C(CCOc1ccc(Cl)cc1)NCCC1CCCNC1
InChIInChI=1S/C16H23ClN2O2.ClH/c17-14-3-5-15(6-4-14)21-11-8-16(20)19-10-7-13-2-1-9-18-12-13;/h3-6,13,18H,1-2,7-12H2,(H,19,20);1H
InChIKeyVXIFKNSPMAXENM-UHFFFAOYSA-N
XLogP3.04
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.29
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-methoxyphenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
CID 119555554
3-(4-methylsulfonylphenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
CID 119558807
2-(4-chlorophenoxy)-N-(2-pyrrolidin-3-ylethyl)acetamide
CID 63624340
N-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride
CID 119555166
4-chloro-N-[4-oxo-4-(2-piperidin-3-ylethylamino)butyl]benzamide;hydrochloride
CID 119557355
3-methoxy-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
CID 119555798
4-(4-ethoxyphenoxy)-N-(2-pyrrolidin-3-ylethyl)butanamide;hydrochloride
CID 119534000
4-[3-oxo-3-(piperidin-3-ylmethylamino)propoxy]benzamide;hydrochloride
CID 119461600
N-(2-piperidin-3-ylethyl)-3-(2,3,5-trimethylphenoxy)propanamide;hydrochloride
CID 119555968
3-(4-chlorophenyl)-N-(2-pyrrolidin-3-ylethyl)propanamide
CID 119534078
3-(4-propoxyphenyl)-N-(2-pyrrolidin-3-ylethyl)propanamide;hydrochloride
CID 119536345
3-(4-aminophenoxy)-N-(2-cyclopentylethyl)propanamide
CID 61102913

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride?
The IUPAC name of 3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride (CID 119555737) is 3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride.
What is the SMILES notation for 3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride?
The canonical SMILES for 3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride is Cl.O=C(CCOc1ccc(Cl)cc1)NCCC1CCCNC1.
What is the InChIKey of 3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride?
The InChIKey is VXIFKNSPMAXENM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23ClN2O2.ClH/c17-14-3-5-15(6-4-14)21-11-8-16(20)19-10-7-13-2-1-9-18-12-13;/h3-6,13,18H,1-2,7-12H2,(H,19,20);1H.
What are the key properties of 3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride?
3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride has a molecular weight of 347.29 g/mol, XLogP of 3.04, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride is sourced from PubChem (CID 119555737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).