1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one

C16H20N6OS — CID 56815378

IUPAC1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(Cc2csc(-c3ncccn3)n2)CC1
InChIInChI=1S/C16H20N6OS/c23-16-19-6-9-22(16)13-2-7-21(8-3-13)10-12-11-24-15(20-12)14-17-4-1-5-18-14/h1,4-5,11,13H,2-3,6-10H2,(H,19,23)
InChIKeyUDXQSIZAMGVNCB-UHFFFAOYSA-N
MW344.44 g/mol
LogP1.59
Rot. Bonds4

About 1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one

1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one (PubChem CID 56815378) has the molecular formula C16H20N6OS and a molecular weight of 344.44 g/mol. Its IUPAC name is 1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one
PubChem CID56815378
Molecular FormulaC16H20N6OS
Molecular Weight344.44 g/mol
Exact Mass344.14
IUPAC Name1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(Cc2csc(-c3ncccn3)n2)CC1
InChIInChI=1S/C16H20N6OS/c23-16-19-6-9-22(16)13-2-7-21(8-3-13)10-12-11-24-15(20-12)14-17-4-1-5-18-14/h1,4-5,11,13H,2-3,6-10H2,(H,19,23)
InChIKeyUDXQSIZAMGVNCB-UHFFFAOYSA-N
XLogP1.59
TPSA74.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.44
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one with MolForge

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Related Compounds

1-[1-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-yl]imidazolidin-2-one
CID 56821531
1-[(3S)-1-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidin-3-yl]imidazolidin-2-one
CID 95590509
4-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]methyl]-2-pyrimidin-2-yl-1,3-thiazole
CID 47052276
1-[1-(1,3-benzoxazol-2-ylmethyl)piperidin-4-yl]imidazolidin-2-one
CID 56815353
1-[1-[[2-[cyclopropyl(methyl)amino]-1,3-thiazol-4-yl]methyl]piperidin-3-yl]imidazolidin-2-one
CID 71915672
(2S,6R)-2,6-dimethyl-4-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]morpholine
CID 94380497
[(2S)-oxolan-2-yl]-[4-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]methanone
CID 51963972
1-(1-propylpiperidin-4-yl)imidazolidin-2-one
CID 18340097
4-(piperazin-1-ylmethyl)-2-pyridin-2-yl-1,3-thiazole;dihydrochloride
CID 82018947
N-[1-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]benzamide
CID 18142784
4-cyclopropyl-3-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methylsulfanyl]-1H-1,2,4-triazol-5-one
CID 47058042
4-(chloromethyl)-2-pyrimidin-2-yl-1,3-thiazole
CID 43622191

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one (CID 56815378) is 1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one is O=C1NCCN1C1CCN(Cc2csc(-c3ncccn3)n2)CC1.
What is the InChIKey of 1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one?
The InChIKey is UDXQSIZAMGVNCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6OS/c23-16-19-6-9-22(16)13-2-7-21(8-3-13)10-12-11-24-15(20-12)14-17-4-1-5-18-14/h1,4-5,11,13H,2-3,6-10H2,(H,19,23).
What are the key properties of 1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one?
1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one has a molecular weight of 344.44 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(2-pyrimidin-2-yl-1,3-thiazol-4-yl)methyl]piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 56815378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).