2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride

C15H23ClN2O2 — CID 170861062

IUPAC2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride
SMILESCl.NCC(=O)c1ccc(OCCC2CCNCC2)cc1
InChIInChI=1S/C15H22N2O2.ClH/c16-11-15(18)13-1-3-14(4-2-13)19-10-7-12-5-8-17-9-6-12;/h1-4,12,17H,5-11,16H2;1H
InChIKeyUVIWSNGFBAAJNM-UHFFFAOYSA-N
MW298.81 g/mol
LogP2.02
Rot. Bonds6

About 2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride

2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride (PubChem CID 170861062) has the molecular formula C15H23ClN2O2 and a molecular weight of 298.81 g/mol. Its IUPAC name is 2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride.

Molecular Properties

Compound Name2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride
PubChem CID170861062
Molecular FormulaC15H23ClN2O2
Molecular Weight298.81 g/mol
Exact Mass298.14
IUPAC Name2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride
SMILESCl.NCC(=O)c1ccc(OCCC2CCNCC2)cc1
InChIInChI=1S/C15H22N2O2.ClH/c16-11-15(18)13-1-3-14(4-2-13)19-10-7-12-5-8-17-9-6-12;/h1-4,12,17H,5-11,16H2;1H
InChIKeyUVIWSNGFBAAJNM-UHFFFAOYSA-N
XLogP2.02
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.81
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-1-[4-(piperidin-4-ylmethoxy)phenyl]ethanone
CID 170861083
2-amino-1-[4-(pyrrolidin-3-ylmethoxy)phenyl]ethanone
CID 170861087
butanedioate;ethane;4-(2-piperidin-4-ylethoxy)benzoate
CID 19748242
4-[2-(4-bromophenoxy)ethyl]piperidine
CID 56830278
2-amino-1-(4-butoxyphenyl)ethanone;hydrochloride
CID 173461436
2-amino-1-(4-propoxyphenyl)ethanone;hydrochloride
CID 50988222
4-[2-(4-propan-2-ylphenoxy)ethyl]piperidine
CID 29077906
methyl 3-(2-piperidin-4-ylethoxy)benzoate;hydrochloride
CID 56830226
4-[2-[4-(1,2-diphenylpent-2-en-3-yl)phenoxy]ethyl]piperidine
CID 70142473
4-[2-(4-butylphenoxy)ethyl]piperidine
CID 115492732
4-[4-(2-cyclohexylethoxy)phenyl]sulfonylpiperidine
CID 59862389
2-amino-1-[4-(azetidin-3-yloxy)phenyl]ethanone
CID 170861053

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride?
The IUPAC name of 2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride (CID 170861062) is 2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride.
What is the SMILES notation for 2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride?
The canonical SMILES for 2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride is Cl.NCC(=O)c1ccc(OCCC2CCNCC2)cc1.
What is the InChIKey of 2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride?
The InChIKey is UVIWSNGFBAAJNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2.ClH/c16-11-15(18)13-1-3-14(4-2-13)19-10-7-12-5-8-17-9-6-12;/h1-4,12,17H,5-11,16H2;1H.
What are the key properties of 2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride?
2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride has a molecular weight of 298.81 g/mol, XLogP of 2.02, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-[4-(2-piperidin-4-ylethoxy)phenyl]ethanone;hydrochloride is sourced from PubChem (CID 170861062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).