N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride

C16H22ClN3O2S — CID 119275013

IUPACN-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCN(C(=O)c2ccccc2)CC1)C1CSCN1
InChIInChI=1S/C16H21N3O2S.ClH/c20-15(14-10-22-11-17-14)18-13-6-8-19(9-7-13)16(21)12-4-2-1-3-5-12;/h1-5,13-14,17H,6-11H2,(H,18,20);1H
InChIKeyFRAIONAQEDEMOH-UHFFFAOYSA-N
MW355.89 g/mol
LogP1.49
Rot. Bonds3

About N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride

N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride (PubChem CID 119275013) has the molecular formula C16H22ClN3O2S and a molecular weight of 355.89 g/mol. Its IUPAC name is N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride
PubChem CID119275013
Molecular FormulaC16H22ClN3O2S
Molecular Weight355.89 g/mol
Exact Mass355.11
IUPAC NameN-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCN(C(=O)c2ccccc2)CC1)C1CSCN1
InChIInChI=1S/C16H21N3O2S.ClH/c20-15(14-10-22-11-17-14)18-13-6-8-19(9-7-13)16(21)12-4-2-1-3-5-12;/h1-5,13-14,17H,6-11H2,(H,18,20);1H
InChIKeyFRAIONAQEDEMOH-UHFFFAOYSA-N
XLogP1.49
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.89
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(3,4-dimethoxybenzoyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide
CID 119330522
N-(1-pyridin-2-ylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119854534
N-(1-benzoylpiperidin-4-yl)cyclopentanecarboxamide
CID 110820191
N-(1-pyrimidin-2-ylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide
CID 43700130
N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide
CID 110821301
N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119270483
1-(1-benzoylpiperidin-4-yl)-3-cyclopropylthiourea
CID 92519828
N-(1-benzoylpiperidin-4-yl)-2-thiomorpholin-3-ylacetamide
CID 119935763
(2R,3S)-N-(1-benzoylpiperidin-4-yl)-2-methylmorpholine-3-carboxamide
CID 120920249
ethane;[4-(methylamino)piperidin-1-yl]-phenylmethanone
CID 145194562
N-(1-benzoylpiperidin-4-yl)-4-phenylbenzamide
CID 108549483
2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]benzoic acid
CID 113083284

Frequently Asked Questions

What is the IUPAC name of N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride (CID 119275013) is N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride is Cl.O=C(NC1CCN(C(=O)c2ccccc2)CC1)C1CSCN1.
What is the InChIKey of N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The InChIKey is FRAIONAQEDEMOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2S.ClH/c20-15(14-10-22-11-17-14)18-13-6-8-19(9-7-13)16(21)12-4-2-1-3-5-12;/h1-5,13-14,17H,6-11H2,(H,18,20);1H.
What are the key properties of N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride has a molecular weight of 355.89 g/mol, XLogP of 1.49, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119275013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).