3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride

C15H22Cl2N2O2 — CID 120554554

IUPAC3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride
SMILESCC1CNCCC1NC(=O)CCOc1ccc(Cl)cc1.Cl
InChIInChI=1S/C15H21ClN2O2.ClH/c1-11-10-17-8-6-14(11)18-15(19)7-9-20-13-4-2-12(16)3-5-13;/h2-5,11,14,17H,6-10H2,1H3,(H,18,19);1H
InChIKeyYHHSPZBFNJXCLK-UHFFFAOYSA-N
MW333.26 g/mol
LogP2.64
Rot. Bonds5

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

3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride (PubChem CID 120554554) has the molecular formula C15H22Cl2N2O2 and a molecular weight of 333.26 g/mol. Its IUPAC name is 3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride.

Molecular Properties

Compound Name3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride
PubChem CID120554554
Molecular FormulaC15H22Cl2N2O2
Molecular Weight333.26 g/mol
Exact Mass332.11
IUPAC Name3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride
SMILESCC1CNCCC1NC(=O)CCOc1ccc(Cl)cc1.Cl
InChIInChI=1S/C15H21ClN2O2.ClH/c1-11-10-17-8-6-14(11)18-15(19)7-9-20-13-4-2-12(16)3-5-13;/h2-5,11,14,17H,6-10H2,1H3,(H,18,19);1H
InChIKeyYHHSPZBFNJXCLK-UHFFFAOYSA-N
XLogP2.64
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.26
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide
CID 79886279
N-(3-methylpiperidin-4-yl)-3-(4-methylsulfonylphenoxy)propanamide;hydrochloride
CID 120556092
4-(4-methoxyphenoxy)-N-(3-methylpiperidin-4-yl)butanamide
CID 120555351
3-(3,5-dimethylphenoxy)-N-(3-methylpiperidin-4-yl)propanamide
CID 120553278
3-(3-methylphenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride
CID 120557730
3-(2-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide
CID 120556122
N-(3-methylpiperidin-4-yl)-2-(4-propoxyphenoxy)acetamide
CID 120555604
3-[3-[(3-methylpiperidin-4-yl)amino]-3-oxopropoxy]benzamide;hydrochloride
CID 120557025
N-(3-methylpiperidin-4-yl)-4-oxo-4-(4-pentoxyphenyl)butanamide
CID 120553976
4-(4-ethoxyphenyl)-N-(3-methylpiperidin-4-yl)-4-oxobutanamide
CID 120555349
3-(2,4-dichlorophenyl)-N-(3-methylpiperidin-4-yl)propanamide
CID 120553265
4-(3-bromophenoxy)-N-(3-methylpiperidin-4-yl)butanamide
CID 120554975

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride?
The IUPAC name of 3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride (CID 120554554) is 3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride.
What is the SMILES notation for 3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride?
The canonical SMILES for 3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride is CC1CNCCC1NC(=O)CCOc1ccc(Cl)cc1.Cl.
What is the InChIKey of 3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride?
The InChIKey is YHHSPZBFNJXCLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O2.ClH/c1-11-10-17-8-6-14(11)18-15(19)7-9-20-13-4-2-12(16)3-5-13;/h2-5,11,14,17H,6-10H2,1H3,(H,18,19);1H.
What are the key properties of 3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride?
3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride has a molecular weight of 333.26 g/mol, XLogP of 2.64, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenoxy)-N-(3-methylpiperidin-4-yl)propanamide;hydrochloride is sourced from PubChem (CID 120554554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).