N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide

C14H22N4O3S — CID 110821301

IUPACN-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide
SMILESO=C1CCC(C(=O)N2CCC(NC(=O)C3CSCN3)CC2)N1
InChIInChI=1S/C14H22N4O3S/c19-12-2-1-10(17-12)14(21)18-5-3-9(4-6-18)16-13(20)11-7-22-8-15-11/h9-11,15H,1-8H2,(H,16,20)(H,17,19)
InChIKeyIVONDLVNCCWBTI-UHFFFAOYSA-N
MW326.42 g/mol
LogP-0.97
Rot. Bonds3

About N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide

N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide (PubChem CID 110821301) has the molecular formula C14H22N4O3S and a molecular weight of 326.42 g/mol. Its IUPAC name is N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound NameN-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide
PubChem CID110821301
Molecular FormulaC14H22N4O3S
Molecular Weight326.42 g/mol
Exact Mass326.14
IUPAC NameN-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide
SMILESO=C1CCC(C(=O)N2CCC(NC(=O)C3CSCN3)CC2)N1
InChIInChI=1S/C14H22N4O3S/c19-12-2-1-10(17-12)14(21)18-5-3-9(4-6-18)16-13(20)11-7-22-8-15-11/h9-11,15H,1-8H2,(H,16,20)(H,17,19)
InChIKeyIVONDLVNCCWBTI-UHFFFAOYSA-N
XLogP-0.97
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.42
LogP ≤ 5-0.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(cyclopentanecarbonyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide
CID 110820011
N-(1-benzoylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119275013
N-(1-pyrimidin-2-ylpiperidin-4-yl)-1,3-thiazolidine-4-carboxamide
CID 43700130
N-[1-(3,4-dimethoxybenzoyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide
CID 119330522
N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]furan-2-carboxamide
CID 110821316
(5R)-5-(pyrrolidine-1-carbonyl)pyrrolidin-2-one
CID 45116190
N-cyclopentyl-4-(1,3-thiazolidine-4-carbonyl)piperazine-1-carboxamide
CID 110812155
N-[1-(2-ethylbutanoyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide
CID 110820091
N-[1-(2-methoxyethyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119861381
N-[1-(2-fluorobenzoyl)piperidin-4-yl]-5-oxopyrrolidine-2-carboxamide
CID 110820368
(2R)-5-oxo-N-piperidin-4-ylpyrrolidine-2-carboxamide
CID 93299792
5-(4-aminopiperidine-1-carbonyl)pyrrolidin-2-one
CID 43556218

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide?
The IUPAC name of N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide (CID 110821301) is N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide is O=C1CCC(C(=O)N2CCC(NC(=O)C3CSCN3)CC2)N1.
What is the InChIKey of N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide?
The InChIKey is IVONDLVNCCWBTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O3S/c19-12-2-1-10(17-12)14(21)18-5-3-9(4-6-18)16-13(20)11-7-22-8-15-11/h9-11,15H,1-8H2,(H,16,20)(H,17,19).
What are the key properties of N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide?
N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide has a molecular weight of 326.42 g/mol, XLogP of -0.97, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-oxopyrrolidine-2-carbonyl)piperidin-4-yl]-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 110821301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).