3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride

C17H30ClN3O2S — CID 119556578

IUPAC3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NCCC1CCCNC1)C1CSCN1C(=O)C1CCCC1
InChIInChI=1S/C17H29N3O2S.ClH/c21-16(19-9-7-13-4-3-8-18-10-13)15-11-23-12-20(15)17(22)14-5-1-2-6-14;/h13-15,18H,1-12H2,(H,19,21);1H
InChIKeyNJIUGIXLPODSJZ-UHFFFAOYSA-N
MW375.97 g/mol
LogP2.01
Rot. Bonds5

About 3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride

3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride (PubChem CID 119556578) has the molecular formula C17H30ClN3O2S and a molecular weight of 375.97 g/mol. Its IUPAC name is 3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
PubChem CID119556578
Molecular FormulaC17H30ClN3O2S
Molecular Weight375.97 g/mol
Exact Mass375.17
IUPAC Name3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NCCC1CCCNC1)C1CSCN1C(=O)C1CCCC1
InChIInChI=1S/C17H29N3O2S.ClH/c21-16(19-9-7-13-4-3-8-18-10-13)15-11-23-12-20(15)17(22)14-5-1-2-6-14;/h13-15,18H,1-12H2,(H,19,21);1H
InChIKeyNJIUGIXLPODSJZ-UHFFFAOYSA-N
XLogP2.01
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.97
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide
CID 119461517
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide;hydrochloride
CID 119557894
3-(2,2-dimethylpropanoyl)-N-(2-pyrrolidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide
CID 119535812
3-pentanoyl-N-(2-pyrrolidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119536892
N-(2-piperidin-3-ylethyl)cyclobutanecarboxamide
CID 60894096
1-butanoyl-N-(2-piperidin-3-ylethyl)piperidine-2-carboxamide;hydrochloride
CID 119555253
N-(2-pyrrolidin-3-ylethyl)cycloheptanecarboxamide;hydrochloride
CID 119537193
N-(2-piperidin-3-ylethyl)bicyclo[3.1.0]hexane-6-carboxamide;hydrochloride
CID 119556041
3-(cyclopentanecarbonyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-1,3-thiazolidine-4-carboxamide
CID 120887829
1-benzyl-N-(2-piperidin-3-ylethyl)piperidine-2-carboxamide;dihydrochloride
CID 119558347
N-(2-piperidin-3-ylethyl)bicyclo[3.1.0]hexane-6-carboxamide
CID 81479536
2-cyclohexyl-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119260693

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The IUPAC name of 3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride (CID 119556578) is 3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride.
What is the SMILES notation for 3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The canonical SMILES for 3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride is Cl.O=C(NCCC1CCCNC1)C1CSCN1C(=O)C1CCCC1.
What is the InChIKey of 3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The InChIKey is NJIUGIXLPODSJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O2S.ClH/c21-16(19-9-7-13-4-3-8-18-10-13)15-11-23-12-20(15)17(22)14-5-1-2-6-14;/h13-15,18H,1-12H2,(H,19,21);1H.
What are the key properties of 3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride has a molecular weight of 375.97 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119556578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).