5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine

C10H17N3S — CID 62693840

IUPAC5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine
SMILESCCc1c(C)nc(CSC)nc1NC
InChIInChI=1S/C10H17N3S/c1-5-8-7(2)12-9(6-14-4)13-10(8)11-3/h5-6H2,1-4H3,(H,11,12,13)
InChIKeyAJIXHABRIRGLCQ-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.25
Rot. Bonds4

About 5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine

5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine (PubChem CID 62693840) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine
PubChem CID62693840
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine
SMILESCCc1c(C)nc(CSC)nc1NC
InChIInChI=1S/C10H17N3S/c1-5-8-7(2)12-9(6-14-4)13-10(8)11-3/h5-6H2,1-4H3,(H,11,12,13)
InChIKeyAJIXHABRIRGLCQ-UHFFFAOYSA-N
XLogP2.25
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-N,6-dimethyl-2-(propan-2-ylsulfanylmethyl)pyrimidin-4-amine
CID 65131341
2-(cyclohexylsulfanylmethyl)-5-ethyl-N,6-dimethylpyrimidin-4-amine
CID 65144264
5-ethyl-N,6-dimethyl-2-(2-methylpropyl)pyrimidin-4-amine
CID 62191080
2-butyl-5-ethyl-N,6-dimethylpyrimidin-4-amine
CID 79412709
5-ethyl-6-methyl-2-(methylsulfanylmethyl)pyrimidin-4-amine
CID 62693645
5-ethyl-2-[(4-fluorophenyl)methyl]-N,6-dimethylpyrimidin-4-amine
CID 62191963
5-ethyl-N,6-dimethyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyrimidin-4-amine
CID 103150290
2,5-diethyl-6-methyl-N-propylpyrimidin-4-amine
CID 62191968
[5-ethyl-6-methyl-2-[(4-methylphenyl)methyl]pyrimidin-4-yl]hydrazine
CID 55061478
[2-[(3,5-dimethylphenyl)methyl]-5-ethyl-6-methylpyrimidin-4-yl]hydrazine
CID 62594082
2-(cyclohexylsulfanylmethyl)-N,5-diethyl-6-methylpyrimidin-4-amine
CID 65144312
N,5-diethyl-6-methyl-2-[(2-methylphenyl)sulfanylmethyl]pyrimidin-4-amine
CID 66097398

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine?
The IUPAC name of 5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine (CID 62693840) is 5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine?
The canonical SMILES for 5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine is CCc1c(C)nc(CSC)nc1NC.
What is the InChIKey of 5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine?
The InChIKey is AJIXHABRIRGLCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-5-8-7(2)12-9(6-14-4)13-10(8)11-3/h5-6H2,1-4H3,(H,11,12,13).
What are the key properties of 5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine?
5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine has a molecular weight of 211.33 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N,6-dimethyl-2-(methylsulfanylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 62693840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).