N-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride

C10H18ClN3O2S — CID 119324352

IUPACN-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCN1CC(NC(=O)C2CSCN2)CCC1=O.Cl
InChIInChI=1S/C10H17N3O2S.ClH/c1-13-4-7(2-3-9(13)14)12-10(15)8-5-16-6-11-8;/h7-8,11H,2-6H2,1H3,(H,12,15);1H
InChIKeyDUROGUZRPUIKPD-UHFFFAOYSA-N
MW279.79 g/mol
LogP-0.19
Rot. Bonds2

About N-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride

N-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride (PubChem CID 119324352) has the molecular formula C10H18ClN3O2S and a molecular weight of 279.79 g/mol. Its IUPAC name is N-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride
PubChem CID119324352
Molecular FormulaC10H18ClN3O2S
Molecular Weight279.79 g/mol
Exact Mass279.08
IUPAC NameN-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCN1CC(NC(=O)C2CSCN2)CCC1=O.Cl
InChIInChI=1S/C10H17N3O2S.ClH/c1-13-4-7(2-3-9(13)14)12-10(15)8-5-16-6-11-8;/h7-8,11H,2-6H2,1H3,(H,12,15);1H
InChIKeyDUROGUZRPUIKPD-UHFFFAOYSA-N
XLogP-0.19
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.79
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(4S)-N-(1-methyl-5-oxopyrrolidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119308806
(2R)-N-(1-methyl-6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide
CID 103796815
4-ethyl-N-(1-methyl-6-oxopiperidin-3-yl)piperidine-2-carboxamide
CID 114429128
N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119270483
N-(3,5-dimethylcyclohexyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119327543
N-(3,3-dimethylcyclopentyl)-1,3-thiazolidine-4-carboxamide
CID 114546365
2,2-dimethyl-3-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 64836587
(3R)-N-(1-methyl-6-oxopiperidin-3-yl)piperidine-3-carboxamide
CID 81141682
N-[1-(2-methoxyethyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119861381
N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide
CID 110821301
N-(1-methyl-5-oxopyrrolidin-3-yl)-5-oxopyrrolidine-2-carboxamide
CID 110745995
2-amino-N-(1-methyl-6-oxopiperidin-3-yl)cyclohexane-1-carboxamide
CID 64668462

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride (CID 119324352) is N-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride is CN1CC(NC(=O)C2CSCN2)CCC1=O.Cl.
What is the InChIKey of N-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The InChIKey is DUROGUZRPUIKPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S.ClH/c1-13-4-7(2-3-9(13)14)12-10(15)8-5-16-6-11-8;/h7-8,11H,2-6H2,1H3,(H,12,15);1H.
What are the key properties of N-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
N-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride has a molecular weight of 279.79 g/mol, XLogP of -0.19, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-6-oxopiperidin-3-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119324352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).