1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one

C16H20N6O2S — CID 133464320

IUPAC1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one
SMILESCN1CCN(c2cc(N3CCOC(c4nccs4)C3)ncn2)CC1=O
InChIInChI=1S/C16H20N6O2S/c1-20-3-4-21(10-15(20)23)13-8-14(19-11-18-13)22-5-6-24-12(9-22)16-17-2-7-25-16/h2,7-8,11-12H,3-6,9-10H2,1H3
InChIKeyOUOGEFWCNIXUAV-UHFFFAOYSA-N
MW360.44 g/mol
LogP0.79
Rot. Bonds3

About 1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one

1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one (PubChem CID 133464320) has the molecular formula C16H20N6O2S and a molecular weight of 360.44 g/mol. Its IUPAC name is 1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one.

Molecular Properties

Compound Name1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one
PubChem CID133464320
Molecular FormulaC16H20N6O2S
Molecular Weight360.44 g/mol
Exact Mass360.14
IUPAC Name1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one
SMILESCN1CCN(c2cc(N3CCOC(c4nccs4)C3)ncn2)CC1=O
InChIInChI=1S/C16H20N6O2S/c1-20-3-4-21(10-15(20)23)13-8-14(19-11-18-13)22-5-6-24-12(9-22)16-17-2-7-25-16/h2,7-8,11-12H,3-6,9-10H2,1H3
InChIKeyOUOGEFWCNIXUAV-UHFFFAOYSA-N
XLogP0.79
TPSA74.69 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.44
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one with MolForge

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Related Compounds

(2S)-4-(5-bromo-4-methyl-2-pyridinyl)-2-(1,3-thiazol-2-yl)morpholine
CID 97327976
1-methyl-4-[6-(2-methylthiomorpholin-4-yl)pyrimidin-4-yl]piperazin-2-one
CID 133464428
N-[(2S,3R)-2-propan-2-yloxan-3-yl]-6-[(2R)-2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-amine
CID 129474501
4-[6-[(3S)-3-hydroxypyrrolidin-1-yl]pyrimidin-4-yl]-1-methylpiperazin-2-one
CID 133464424
6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyridine-2-carboxylic acid
CID 122053464
1-methyl-4-[6-[4-(oxan-4-yl)piperazin-1-yl]pyrimidin-4-yl]piperazin-2-one
CID 133492404
1-[6-(4-methyl-3-oxopiperazin-1-yl)pyrimidin-4-yl]piperidine-3-carboxylic acid
CID 122051078
4-(6-aminopyrimidin-4-yl)-1-methylpiperazin-2-one
CID 80843839
4-[6-[3-(methoxymethyl)piperidin-1-yl]pyrimidin-4-yl]-1-methylpiperazin-2-one
CID 133464582
1,3-dimethyl-2,4-dioxo-6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidine-5-carbonitrile
CID 133280874
2-[2-(1,3-thiazol-2-yl)morpholin-4-yl]benzene-1,3-dicarbonitrile
CID 154840622
(2S)-4-imidazo[1,2-a]pyrazin-8-yl-2-(1,3-thiazol-2-yl)morpholine
CID 164634498

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one?
The IUPAC name of 1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one (CID 133464320) is 1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one.
What is the SMILES notation for 1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one?
The canonical SMILES for 1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one is CN1CCN(c2cc(N3CCOC(c4nccs4)C3)ncn2)CC1=O.
What is the InChIKey of 1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one?
The InChIKey is OUOGEFWCNIXUAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6O2S/c1-20-3-4-21(10-15(20)23)13-8-14(19-11-18-13)22-5-6-24-12(9-22)16-17-2-7-25-16/h2,7-8,11-12H,3-6,9-10H2,1H3.
What are the key properties of 1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one?
1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one has a molecular weight of 360.44 g/mol, XLogP of 0.79, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyrimidin-4-yl]piperazin-2-one is sourced from PubChem (CID 133464320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).