6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine

C7H10ClN3S — CID 71303951

IUPAC6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine
SMILESCCc1c(N)nc(SC)nc1Cl
InChIInChI=1S/C7H10ClN3S/c1-3-4-5(8)10-7(12-2)11-6(4)9/h3H2,1-2H3,(H2,9,10,11)
InChIKeyYLCWKOLBVHPENA-UHFFFAOYSA-N
MW203.70 g/mol
LogP2.00
Rot. Bonds2

About 6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine

6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine (PubChem CID 71303951) has the molecular formula C7H10ClN3S and a molecular weight of 203.70 g/mol. Its IUPAC name is 6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine
PubChem CID71303951
Molecular FormulaC7H10ClN3S
Molecular Weight203.70 g/mol
Exact Mass203.03
IUPAC Name6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine
SMILESCCc1c(N)nc(SC)nc1Cl
InChIInChI=1S/C7H10ClN3S/c1-3-4-5(8)10-7(12-2)11-6(4)9/h3H2,1-2H3,(H2,9,10,11)
InChIKeyYLCWKOLBVHPENA-UHFFFAOYSA-N
XLogP2.00
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.70
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-5-chloro-2-methylsulfanylpyrimidine-4-carboxylic acid
CID 83872138
(4-chloro-6-methyl-2-methylsulfanylpyrimidin-5-yl)methanol
CID 88942303
2-methylsulfanylpyrimidine-4,5,6-triamine;dihydrochloride
CID 69051761
(4-chloro-6-methoxy-2-methylsulfanylpyrimidin-5-yl)methanol
CID 130899452
5,6-dichloro-2-methylsulfanyl-N-propan-2-ylpyrimidin-4-amine
CID 88769703
4,6-dichloro-5-methoxy-2-methylsulfanylpyrimidine
CID 15003627
2-[4-chloro-2-methylsulfanyl-6-(propan-2-ylamino)pyrimidin-5-yl]acetaldehyde
CID 101246015
3-(4,6-dichloro-2-methylsulfanylpyrimidin-5-yl)propylcarbamic acid
CID 174191947
[4-chloro-6-[12-[6-chloro-2-methylsulfanyl-5-(oxidomethyl)pyrimidin-4-yl]-3,12-diaza-6,9-diazoniadispiro[5.2.59.26]hexadecan-3-yl]-2-methylsulfanylpyrimidin-5-yl]methanolate
CID 44594806
4-chloro-6-(fluoromethyl)-5-methyl-2-methylsulfanylpyrimidine
CID 91248195
6-chloro-5-octyl-2-propylpyrimidin-4-amine
CID 154161263
2-ethyl-5-methylsulfanyl-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine
CID 70951796

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine?
The IUPAC name of 6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine (CID 71303951) is 6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine.
What is the SMILES notation for 6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine?
The canonical SMILES for 6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine is CCc1c(N)nc(SC)nc1Cl.
What is the InChIKey of 6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine?
The InChIKey is YLCWKOLBVHPENA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN3S/c1-3-4-5(8)10-7(12-2)11-6(4)9/h3H2,1-2H3,(H2,9,10,11).
What are the key properties of 6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine?
6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine has a molecular weight of 203.70 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-ethyl-2-methylsulfanylpyrimidin-4-amine is sourced from PubChem (CID 71303951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).