3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride

C16H25ClN2O3 — CID 120598284

IUPAC3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride
SMILESCOc1ccc(OCCC(=O)NC2CCNC(C)C2)cc1.Cl
InChIInChI=1S/C16H24N2O3.ClH/c1-12-11-13(7-9-17-12)18-16(19)8-10-21-15-5-3-14(20-2)4-6-15;/h3-6,12-13,17H,7-11H2,1-2H3,(H,18,19);1H
InChIKeyLOYJGFRQNRADDA-UHFFFAOYSA-N
MW328.84 g/mol
LogP2.14
Rot. Bonds6

About 3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride

3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride (PubChem CID 120598284) has the molecular formula C16H25ClN2O3 and a molecular weight of 328.84 g/mol. Its IUPAC name is 3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride.

Molecular Properties

Compound Name3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride
PubChem CID120598284
Molecular FormulaC16H25ClN2O3
Molecular Weight328.84 g/mol
Exact Mass328.16
IUPAC Name3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride
SMILESCOc1ccc(OCCC(=O)NC2CCNC(C)C2)cc1.Cl
InChIInChI=1S/C16H24N2O3.ClH/c1-12-11-13(7-9-17-12)18-16(19)8-10-21-15-5-3-14(20-2)4-6-15;/h3-6,12-13,17H,7-11H2,1-2H3,(H,18,19);1H
InChIKeyLOYJGFRQNRADDA-UHFFFAOYSA-N
XLogP2.14
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.84
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3,4-dimethylphenoxy)-N-(2-methylpiperidin-4-yl)propanamide
CID 120597846
3-(4-methoxyphenoxy)-N-piperidin-3-ylpropanamide;hydrochloride
CID 119424848
4-(2-methoxyethoxy)-N-(2-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120601539
N-cyclohexyl-3-(4-methoxyphenoxy)propanamide
CID 974927
4-(3,4-dimethylphenoxy)-N-(2-methylpiperidin-4-yl)butanamide
CID 120602231
3-(3-methoxyphenyl)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride
CID 120601809
4-methoxy-N-(2-methylpiperidin-4-yl)benzamide
CID 106995490
2-(3-methoxyphenyl)-N-(2-methylpiperidin-4-yl)acetamide;hydrochloride
CID 120601993
5-(3-methylphenoxy)-N-(2-methylpiperidin-4-yl)pentanamide
CID 120600867
N-(2-methylpiperidin-4-yl)-3-(2-nitrophenoxy)propanamide;hydrochloride
CID 120601482
N-(2-methylpiperidin-4-yl)-3-(2,3,5-trimethylphenoxy)propanamide
CID 120597993
3-(3,4-dimethoxyphenyl)sulfanyl-N-(2-methylpiperidin-4-yl)propanamide
CID 120598164

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride?
The IUPAC name of 3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride (CID 120598284) is 3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride.
What is the SMILES notation for 3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride?
The canonical SMILES for 3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride is COc1ccc(OCCC(=O)NC2CCNC(C)C2)cc1.Cl.
What is the InChIKey of 3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride?
The InChIKey is LOYJGFRQNRADDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3.ClH/c1-12-11-13(7-9-17-12)18-16(19)8-10-21-15-5-3-14(20-2)4-6-15;/h3-6,12-13,17H,7-11H2,1-2H3,(H,18,19);1H.
What are the key properties of 3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride?
3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride has a molecular weight of 328.84 g/mol, XLogP of 2.14, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenoxy)-N-(2-methylpiperidin-4-yl)propanamide;hydrochloride is sourced from PubChem (CID 120598284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).