3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide

C12H17N5O2S — CID 47079402

IUPAC3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide
SMILESO=C(Nc1nccs1)N1CCCC(N2CCNC2=O)C1
InChIInChI=1S/C12H17N5O2S/c18-11-14-3-6-17(11)9-2-1-5-16(8-9)12(19)15-10-13-4-7-20-10/h4,7,9H,1-3,5-6,8H2,(H,14,18)(H,13,15,19)
InChIKeyYUNOORYQDYDRHZ-UHFFFAOYSA-N
MW295.37 g/mol
LogP1.16
Rot. Bonds2

About 3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide

3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide (PubChem CID 47079402) has the molecular formula C12H17N5O2S and a molecular weight of 295.37 g/mol. Its IUPAC name is 3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide
PubChem CID47079402
Molecular FormulaC12H17N5O2S
Molecular Weight295.37 g/mol
Exact Mass295.11
IUPAC Name3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide
SMILESO=C(Nc1nccs1)N1CCCC(N2CCNC2=O)C1
InChIInChI=1S/C12H17N5O2S/c18-11-14-3-6-17(11)9-2-1-5-16(8-9)12(19)15-10-13-4-7-20-10/h4,7,9H,1-3,5-6,8H2,(H,14,18)(H,13,15,19)
InChIKeyYUNOORYQDYDRHZ-UHFFFAOYSA-N
XLogP1.16
TPSA77.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.37
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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2-(1,3-Thiazol-2-yl)-2,5-diazabicyclo[2.2.1]heptane
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1-[2-(1-Piperidyl)ethyl]-3-thiazol-2-yl-thiourea
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1-((2S)-pyrrolidine-2-carbonyl)-4-(1,3-thiazol-2-yl)piperazine dihydrochloride
CID 71756998
N1-(3-(2-oxopyrrolidin-1-yl)propyl)-N2-(thiazol-2-yl)oxalamide
CID 18588848
N-cyclopentyl-2-(1,3-thiazol-2-ylcarbamoylamino)propanamide
CID 47076630
2-[4-(1,3-Thiazol-2-ylcarbamoylamino)piperidin-1-yl]acetamide
CID 47152076
1-[3-(1,3-Thiazol-2-ylcarbamoylamino)propyl]piperidine-4-carboxamide
CID 56796137
1-[1-[3-(1,3-Thiazol-2-yl)propanoyl]piperidin-4-yl]imidazolidin-2-one
CID 56818955
1-[1-[3-(1,3-Thiazol-2-yl)propanoyl]piperidin-3-yl]imidazolidin-2-one
CID 56821751

Frequently Asked Questions

What is the IUPAC name of 3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide?
The IUPAC name of 3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide (CID 47079402) is 3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for 3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide?
The canonical SMILES for 3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide is O=C(Nc1nccs1)N1CCCC(N2CCNC2=O)C1.
What is the InChIKey of 3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide?
The InChIKey is YUNOORYQDYDRHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O2S/c18-11-14-3-6-17(11)9-2-1-5-16(8-9)12(19)15-10-13-4-7-20-10/h4,7,9H,1-3,5-6,8H2,(H,14,18)(H,13,15,19).
What are the key properties of 3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide?
3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide has a molecular weight of 295.37 g/mol, XLogP of 1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-oxoimidazolidin-1-yl)-N-(1,3-thiazol-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 47079402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).