1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one

C14H17N5OS — CID 56815569

IUPAC1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(c2ncnc3sccc23)CC1
InChIInChI=1S/C14H17N5OS/c20-14-15-4-7-19(14)10-1-5-18(6-2-10)12-11-3-8-21-13(11)17-9-16-12/h3,8-10H,1-2,4-7H2,(H,15,20)
InChIKeyXCXJYLRPTBJSAN-UHFFFAOYSA-N
MW303.39 g/mol
LogP1.69
Rot. Bonds2

About 1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one

1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one (PubChem CID 56815569) has the molecular formula C14H17N5OS and a molecular weight of 303.39 g/mol. Its IUPAC name is 1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one
PubChem CID56815569
Molecular FormulaC14H17N5OS
Molecular Weight303.39 g/mol
Exact Mass303.12
IUPAC Name1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(c2ncnc3sccc23)CC1
InChIInChI=1S/C14H17N5OS/c20-14-15-4-7-19(14)10-1-5-18(6-2-10)12-11-3-8-21-13(11)17-9-16-12/h3,8-10H,1-2,4-7H2,(H,15,20)
InChIKeyXCXJYLRPTBJSAN-UHFFFAOYSA-N
XLogP1.69
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.39
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(4-pyrrol-1-ylpiperidin-1-yl)thieno[2,3-d]pyrimidine
CID 56822117
4-thieno[2,3-d]pyrimidin-4-ylpiperazin-2-one
CID 9113696
(7S)-7-methyl-1-thieno[2,3-d]pyrimidin-4-yl-1,4-diazepan-5-one
CID 95617650
1-thieno[2,3-d]pyrimidin-4-ylpiperidine-4-carboxamide
CID 2098585
4-(4-pyrrolidin-2-ylpiperidin-1-yl)thieno[2,3-d]pyrimidine
CID 63256925
4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)thieno[2,3-d]pyrimidine
CID 157019262
1-thieno[2,3-d]pyrimidin-4-ylpyrrolidine-3-carboxylic acid
CID 63030992
2-[methyl-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)amino]ethanol
CID 39817579
4-[4-(pyrazin-2-yloxymethyl)piperidin-1-yl]thieno[2,3-d]pyrimidine
CID 154583426
4-[3-(chloromethyl)pyrrolidin-1-yl]thieno[2,3-d]pyrimidine
CID 63390055
4-thieno[2,3-d]pyrimidin-4-ylmorpholine
CID 2457329
N-methyl-N-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)cyclopropanesulfonamide
CID 163346392

Frequently Asked Questions

What is the IUPAC name of 1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one?
The IUPAC name of 1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one (CID 56815569) is 1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one.
What is the SMILES notation for 1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one?
The canonical SMILES for 1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one is O=C1NCCN1C1CCN(c2ncnc3sccc23)CC1.
What is the InChIKey of 1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one?
The InChIKey is XCXJYLRPTBJSAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5OS/c20-14-15-4-7-19(14)10-1-5-18(6-2-10)12-11-3-8-21-13(11)17-9-16-12/h3,8-10H,1-2,4-7H2,(H,15,20).
What are the key properties of 1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one?
1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one has a molecular weight of 303.39 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-thieno[2,3-d]pyrimidin-4-ylpiperidin-4-yl)imidazolidin-2-one is sourced from PubChem (CID 56815569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).