N,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine

C9H10N4OS — CID 106928309

IUPACN,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine
SMILESCNc1ncc(C)c(Sc2ncco2)n1
InChIInChI=1S/C9H10N4OS/c1-6-5-12-8(10-2)13-7(6)15-9-11-3-4-14-9/h3-5H,1-2H3,(H,10,12,13)
InChIKeyJPVJDPSIZSQGTB-UHFFFAOYSA-N
MW222.27 g/mol
LogP1.97
Rot. Bonds3

About N,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine

N,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine (PubChem CID 106928309) has the molecular formula C9H10N4OS and a molecular weight of 222.27 g/mol. Its IUPAC name is N,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine.

Molecular Properties

Compound NameN,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine
PubChem CID106928309
Molecular FormulaC9H10N4OS
Molecular Weight222.27 g/mol
Exact Mass222.06
IUPAC NameN,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine
SMILESCNc1ncc(C)c(Sc2ncco2)n1
InChIInChI=1S/C9H10N4OS/c1-6-5-12-8(10-2)13-7(6)15-9-11-3-4-14-9/h3-5H,1-2H3,(H,10,12,13)
InChIKeyJPVJDPSIZSQGTB-UHFFFAOYSA-N
XLogP1.97
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.27
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-5-methyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine
CID 106928372
4-tert-butylsulfanyl-N,5-dimethylpyrimidin-2-amine
CID 80888484
5-bromo-4-(1,3-oxazol-2-ylsulfanyl)-N-propylpyrimidin-2-amine
CID 106928329
2-[5-methyl-2-(methylamino)pyrimidin-4-yl]sulfanylethanol
CID 80885145
N,5-dimethyl-4-propylsulfanylpyrimidin-2-amine
CID 80887439
4-(2,5-dimethylpyrazol-3-yl)sulfanyl-N,5-dimethylpyrimidin-2-amine
CID 80889068
2-methyl-3-[5-methyl-2-(methylamino)pyrimidin-4-yl]sulfanyl-1H-1,2,4-triazine-5,6-dione
CID 107785336
[4-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-5-methylpyrimidin-2-yl]hydrazine
CID 106928882
5-methyl-4-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]-N-propylpyrimidin-2-amine
CID 106928450
5-methyl-3-(1,3-oxazol-2-ylsulfanyl)-1,4-thiazin-2-one
CID 139684893
N-ethyl-5-methyl-6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine
CID 106928319
2-methyl-N-[[5-methyl-6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]methyl]propan-2-amine
CID 106926551

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine?
The IUPAC name of N,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine (CID 106928309) is N,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine.
What is the SMILES notation for N,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine?
The canonical SMILES for N,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine is CNc1ncc(C)c(Sc2ncco2)n1.
What is the InChIKey of N,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine?
The InChIKey is JPVJDPSIZSQGTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4OS/c1-6-5-12-8(10-2)13-7(6)15-9-11-3-4-14-9/h3-5H,1-2H3,(H,10,12,13).
What are the key properties of N,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine?
N,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine has a molecular weight of 222.27 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-4-(1,3-oxazol-2-ylsulfanyl)pyrimidin-2-amine is sourced from PubChem (CID 106928309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).