3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride

C14H19Cl3N2O — CID 119428293

IUPAC3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride
SMILESCl.O=C(CCc1ccc(Cl)cc1Cl)NC1CCCNC1
InChIInChI=1S/C14H18Cl2N2O.ClH/c15-11-5-3-10(13(16)8-11)4-6-14(19)18-12-2-1-7-17-9-12;/h3,5,8,12,17H,1-2,4,6-7,9H2,(H,18,19);1H
InChIKeyIKASNDLPEBFHCF-UHFFFAOYSA-N
MW337.68 g/mol
LogP3.22
Rot. Bonds4

About 3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride

3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride (PubChem CID 119428293) has the molecular formula C14H19Cl3N2O and a molecular weight of 337.68 g/mol. Its IUPAC name is 3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride.

Molecular Properties

Compound Name3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride
PubChem CID119428293
Molecular FormulaC14H19Cl3N2O
Molecular Weight337.68 g/mol
Exact Mass336.06
IUPAC Name3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride
SMILESCl.O=C(CCc1ccc(Cl)cc1Cl)NC1CCCNC1
InChIInChI=1S/C14H18Cl2N2O.ClH/c15-11-5-3-10(13(16)8-11)4-6-14(19)18-12-2-1-7-17-9-12;/h3,5,8,12,17H,1-2,4,6-7,9H2,(H,18,19);1H
InChIKeyIKASNDLPEBFHCF-UHFFFAOYSA-N
XLogP3.22
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.68
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,4-dichlorophenyl)-N-(3-methylpiperidin-4-yl)propanamide
CID 120553265
3-(2,4-dimethylphenyl)-N-piperidin-3-ylpropanamide;hydrochloride
CID 91645265
2-[(2,4-dichlorophenyl)methylsulfanyl]-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119451069
2-(2,4-dichlorophenyl)-N-(piperidin-3-ylmethyl)acetamide;hydrochloride
CID 119459765
3-(4-chloro-2-nitrophenoxy)-N-piperidin-3-ylpropanamide;hydrochloride
CID 119426675
N-[2-(aminomethyl)cyclopentyl]-3-(2,4-dichlorophenyl)propanamide;hydrochloride
CID 119604388
2-(4-chlorophenyl)sulfanyl-N-piperidin-3-ylacetamide
CID 119427074
3-(2,4-dichlorophenyl)-N-[2-(hydroxymethyl)cyclopentyl]propanamide
CID 103751500
N-[(2,4-dichlorophenyl)methyl]piperidine-3-carboxamide;hydrochloride
CID 119263512
2-(4-chlorophenyl)-N-pyrrolidin-3-ylacetamide
CID 62379159
N-[2-(aminomethyl)cyclopentyl]-3-(2,4-dichlorophenyl)propanamide
CID 119604389
3-(1-methylpyrazol-4-yl)-N-piperidin-3-ylpropanamide;dihydrochloride
CID 119427806

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride?
The IUPAC name of 3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride (CID 119428293) is 3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride.
What is the SMILES notation for 3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride?
The canonical SMILES for 3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride is Cl.O=C(CCc1ccc(Cl)cc1Cl)NC1CCCNC1.
What is the InChIKey of 3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride?
The InChIKey is IKASNDLPEBFHCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2N2O.ClH/c15-11-5-3-10(13(16)8-11)4-6-14(19)18-12-2-1-7-17-9-12;/h3,5,8,12,17H,1-2,4,6-7,9H2,(H,18,19);1H.
What are the key properties of 3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride?
3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride has a molecular weight of 337.68 g/mol, XLogP of 3.22, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dichlorophenyl)-N-piperidin-3-ylpropanamide;hydrochloride is sourced from PubChem (CID 119428293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).