N,6-dimethyl-2-methylsulfanylpyrimidin-4-amine

C7H11N3S — CID 68651067

IUPACN,6-dimethyl-2-methylsulfanylpyrimidin-4-amine
SMILESCNc1cc(C)nc(SC)n1
InChIInChI=1S/C7H11N3S/c1-5-4-6(8-2)10-7(9-5)11-3/h4H,1-3H3,(H,8,9,10)
InChIKeyGSANILWKNPZOQR-UHFFFAOYSA-N
MW169.25 g/mol
LogP1.55
Rot. Bonds2

About N,6-dimethyl-2-methylsulfanylpyrimidin-4-amine

N,6-dimethyl-2-methylsulfanylpyrimidin-4-amine (PubChem CID 68651067) has the molecular formula C7H11N3S and a molecular weight of 169.25 g/mol. Its IUPAC name is N,6-dimethyl-2-methylsulfanylpyrimidin-4-amine.

Molecular Properties

Compound NameN,6-dimethyl-2-methylsulfanylpyrimidin-4-amine
PubChem CID68651067
Molecular FormulaC7H11N3S
Molecular Weight169.25 g/mol
Exact Mass169.07
IUPAC NameN,6-dimethyl-2-methylsulfanylpyrimidin-4-amine
SMILESCNc1cc(C)nc(SC)n1
InChIInChI=1S/C7H11N3S/c1-5-4-6(8-2)10-7(9-5)11-3/h4H,1-3H3,(H,8,9,10)
InChIKeyGSANILWKNPZOQR-UHFFFAOYSA-N
XLogP1.55
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Crimidine
CID 10813
2,6-Dimethyl-4-aminopyrimidine
CID 68039
2-Chloro-6-methylpyrimidin-4-amine
CID 312629
6-Methylpyrimidin-4-amine
CID 572852
4,6-Dimethyl-2-(methylsulfanyl)pyrimidine
CID 12343174
2-chloro-N-ethyl-6-methylpyrimidin-4-amine
CID 312603
6-methyl-2-N,4-N-di(propan-2-yl)pyrimidine-2,4-diamine
CID 46225978
6-Methyl-2,4-pyrimidinediamine
CID 229743
4-Pyrimidinamine, 2-((1-methylethyl)thio)-N,N,6-trimethyl-
CID 660772
4-Iodo-6-methyl-2-methylthio-pyrimidine
CID 2736660
N4,N4,6-trimethylpyrimidine-2,4-diamine
CID 13729300
(6-Methyl-2-methylsulfanyl-pyrimidin-4-yl)-urea
CID 650834

Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-2-methylsulfanylpyrimidin-4-amine?
The IUPAC name of N,6-dimethyl-2-methylsulfanylpyrimidin-4-amine (CID 68651067) is N,6-dimethyl-2-methylsulfanylpyrimidin-4-amine.
What is the SMILES notation for N,6-dimethyl-2-methylsulfanylpyrimidin-4-amine?
The canonical SMILES for N,6-dimethyl-2-methylsulfanylpyrimidin-4-amine is CNc1cc(C)nc(SC)n1.
What is the InChIKey of N,6-dimethyl-2-methylsulfanylpyrimidin-4-amine?
The InChIKey is GSANILWKNPZOQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3S/c1-5-4-6(8-2)10-7(9-5)11-3/h4H,1-3H3,(H,8,9,10).
What are the key properties of N,6-dimethyl-2-methylsulfanylpyrimidin-4-amine?
N,6-dimethyl-2-methylsulfanylpyrimidin-4-amine has a molecular weight of 169.25 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-2-methylsulfanylpyrimidin-4-amine is sourced from PubChem (CID 68651067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).