3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride

C15H24Cl2N2OS — CID 119824116

IUPAC3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
SMILESCCCN(C(=O)CCc1ccc(Cl)s1)C1CCNCC1.Cl
InChIInChI=1S/C15H23ClN2OS.ClH/c1-2-11-18(12-7-9-17-10-8-12)15(19)6-4-13-3-5-14(16)20-13;/h3,5,12,17H,2,4,6-11H2,1H3;1H
InChIKeyQTFLEVXXHWZIMN-UHFFFAOYSA-N
MW351.34 g/mol
LogP3.75
Rot. Bonds6

About 3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride

3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride (PubChem CID 119824116) has the molecular formula C15H24Cl2N2OS and a molecular weight of 351.34 g/mol. Its IUPAC name is 3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride.

Molecular Properties

Compound Name3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
PubChem CID119824116
Molecular FormulaC15H24Cl2N2OS
Molecular Weight351.34 g/mol
Exact Mass350.10
IUPAC Name3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
SMILESCCCN(C(=O)CCc1ccc(Cl)s1)C1CCNCC1.Cl
InChIInChI=1S/C15H23ClN2OS.ClH/c1-2-11-18(12-7-9-17-10-8-12)15(19)6-4-13-3-5-14(16)20-13;/h3,5,12,17H,2,4,6-11H2,1H3;1H
InChIKeyQTFLEVXXHWZIMN-UHFFFAOYSA-N
XLogP3.75
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.34
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-chlorophenyl)sulfanyl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119824335
4-(3,4-dichlorophenyl)-N-piperidin-4-yl-N-propylbutanamide;hydrochloride
CID 119824958
3-naphthalen-2-yl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119825837
2,5-dichloro-N-piperidin-4-yl-N-propylthiophene-3-carboxamide;hydrochloride
CID 119824416
2-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]-N-propyl-N-pyrrolidin-3-ylacetamide;dihydrochloride
CID 119533102
N-piperidin-4-yl-N-propylhexanamide
CID 60807623
5-(4-methylphenyl)-N-piperidin-4-yl-N-propylpentanamide
CID 119823684
3-(5-phenyl-1,3-oxazol-2-yl)-N-piperidin-4-yl-N-propylpropanamide;dihydrochloride
CID 119823979
3-(2,4-dichlorophenoxy)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119825395
3-(5-chlorothiophen-2-yl)-N-cyclopentyl-N-propan-2-ylpropanamide
CID 56517861
3-(5-chlorothiophen-2-yl)-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119451026
3-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]-N-propyl-N-pyrrolidin-3-ylpropanamide;dihydrochloride
CID 126773837

Frequently Asked Questions

What is the IUPAC name of 3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride?
The IUPAC name of 3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride (CID 119824116) is 3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride.
What is the SMILES notation for 3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride?
The canonical SMILES for 3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride is CCCN(C(=O)CCc1ccc(Cl)s1)C1CCNCC1.Cl.
What is the InChIKey of 3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride?
The InChIKey is QTFLEVXXHWZIMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN2OS.ClH/c1-2-11-18(12-7-9-17-10-8-12)15(19)6-4-13-3-5-14(16)20-13;/h3,5,12,17H,2,4,6-11H2,1H3;1H.
What are the key properties of 3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride?
3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride has a molecular weight of 351.34 g/mol, XLogP of 3.75, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-chlorothiophen-2-yl)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride is sourced from PubChem (CID 119824116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).