6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine

C10H12N4OS — CID 106928339

IUPAC6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1nc(N)cc(Sc2ncco2)n1
InChIInChI=1S/C10H12N4OS/c1-6(2)9-13-7(11)5-8(14-9)16-10-12-3-4-15-10/h3-6H,1-2H3,(H2,11,13,14)
InChIKeyZWYCSJISTJHNBO-UHFFFAOYSA-N
MW236.30 g/mol
LogP2.32
Rot. Bonds3

About 6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine

6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine (PubChem CID 106928339) has the molecular formula C10H12N4OS and a molecular weight of 236.30 g/mol. Its IUPAC name is 6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine
PubChem CID106928339
Molecular FormulaC10H12N4OS
Molecular Weight236.30 g/mol
Exact Mass236.07
IUPAC Name6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine
SMILESCC(C)c1nc(N)cc(Sc2ncco2)n1
InChIInChI=1S/C10H12N4OS/c1-6(2)9-13-7(11)5-8(14-9)16-10-12-3-4-15-10/h3-6H,1-2H3,(H2,11,13,14)
InChIKeyZWYCSJISTJHNBO-UHFFFAOYSA-N
XLogP2.32
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)sulfanyl-1,3-oxazole
CID 106923363
6-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]-2-propan-2-ylpyrimidin-4-amine
CID 106928531
5-(1,3-oxazol-2-ylsulfanyl)pyrazin-2-amine
CID 106928163
6-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-2-propan-2-ylpyrimidin-4-amine
CID 115384369
6-(4-bromophenyl)sulfanyl-2-propan-2-ylpyrimidin-4-amine
CID 80962300
6-(3,4-dichlorophenyl)sulfanyl-2-propan-2-ylpyrimidin-4-amine
CID 80963744
6-(4-tert-butylphenyl)sulfanyl-2-propan-2-ylpyrimidin-4-amine
CID 80962911
N-ethyl-5-methyl-6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine
CID 106928319
2-(1,3-oxazol-2-ylsulfanyl)pyrimidin-4-amine
CID 106928161
(1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine
CID 106923159
2-(5-bromopyrimidin-2-yl)sulfanyl-1,3-oxazole
CID 106898503
6-(3-methylbutylsulfanyl)-2-propan-2-ylpyrimidin-4-amine
CID 107765975

Frequently Asked Questions

What is the IUPAC name of 6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine (CID 106928339) is 6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine is CC(C)c1nc(N)cc(Sc2ncco2)n1.
What is the InChIKey of 6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is ZWYCSJISTJHNBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4OS/c1-6(2)9-13-7(11)5-8(14-9)16-10-12-3-4-15-10/h3-6H,1-2H3,(H2,11,13,14).
What are the key properties of 6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine?
6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 236.30 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 106928339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).