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

C18H29ClN2O3 — CID 119555166

IUPACN-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride
SMILESCCCOc1ccc(OCC(=O)NCCC2CCCNC2)cc1.Cl
InChIInChI=1S/C18H28N2O3.ClH/c1-2-12-22-16-5-7-17(8-6-16)23-14-18(21)20-11-9-15-4-3-10-19-13-15;/h5-8,15,19H,2-4,9-14H2,1H3,(H,20,21);1H
InChIKeyUTNMUZNLLZZXCU-UHFFFAOYSA-N
MW356.89 g/mol
LogP2.78
Rot. Bonds9

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

N-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride (PubChem CID 119555166) has the molecular formula C18H29ClN2O3 and a molecular weight of 356.89 g/mol. Its IUPAC name is N-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride
PubChem CID119555166
Molecular FormulaC18H29ClN2O3
Molecular Weight356.89 g/mol
Exact Mass356.19
IUPAC NameN-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride
SMILESCCCOc1ccc(OCC(=O)NCCC2CCCNC2)cc1.Cl
InChIInChI=1S/C18H28N2O3.ClH/c1-2-12-22-16-5-7-17(8-6-16)23-14-18(21)20-11-9-15-4-3-10-19-13-15;/h5-8,15,19H,2-4,9-14H2,1H3,(H,20,21);1H
InChIKeyUTNMUZNLLZZXCU-UHFFFAOYSA-N
XLogP2.78
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.89
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-propoxyphenyl)-N-(2-pyrrolidin-3-ylethyl)propanamide;hydrochloride
CID 119536345
3-(4-methoxyphenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
CID 119555554
3-(4-chlorophenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
CID 119555737
2-butoxy-N-(2-piperidin-3-ylethyl)acetamide
CID 119556293
3-(4-methylsulfonylphenoxy)-N-(2-piperidin-3-ylethyl)propanamide;hydrochloride
CID 119558807
2-(4-propan-2-ylphenoxy)-N-(2-pyrrolidin-3-ylethyl)acetamide;hydrochloride
CID 119536634
2-(4-chlorophenoxy)-N-(2-pyrrolidin-3-ylethyl)acetamide
CID 63624340
2-(3-bromophenoxy)-N-(2-piperidin-3-ylethyl)acetamide
CID 119557900
4-(4-ethoxyphenoxy)-N-(2-pyrrolidin-3-ylethyl)butanamide;hydrochloride
CID 119534000
2-(3,4-dimethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide;hydrochloride
CID 119461053
N-(2-piperidin-3-ylethyl)-3,4-dipropoxybenzamide;hydrochloride
CID 119558696
2-(4-ethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide
CID 119460422

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride?
The IUPAC name of N-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride (CID 119555166) is N-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride.
What is the SMILES notation for N-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride?
The canonical SMILES for N-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride is CCCOc1ccc(OCC(=O)NCCC2CCCNC2)cc1.Cl.
What is the InChIKey of N-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride?
The InChIKey is UTNMUZNLLZZXCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O3.ClH/c1-2-12-22-16-5-7-17(8-6-16)23-14-18(21)20-11-9-15-4-3-10-19-13-15;/h5-8,15,19H,2-4,9-14H2,1H3,(H,20,21);1H.
What are the key properties of N-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride?
N-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride has a molecular weight of 356.89 g/mol, XLogP of 2.78, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-3-ylethyl)-2-(4-propoxyphenoxy)acetamide;hydrochloride is sourced from PubChem (CID 119555166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).