2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine

C10H15N3S — CID 80991192

IUPAC2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine
SMILESCCSc1nc(C2CC2)nc(N)c1C
InChIInChI=1S/C10H15N3S/c1-3-14-10-6(2)8(11)12-9(13-10)7-4-5-7/h7H,3-5H2,1-2H3,(H2,11,12,13)
InChIKeyPYOQJAYLKDJKGT-UHFFFAOYSA-N
MW209.32 g/mol
LogP2.36
Rot. Bonds3

About 2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine

2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine (PubChem CID 80991192) has the molecular formula C10H15N3S and a molecular weight of 209.32 g/mol. Its IUPAC name is 2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine
PubChem CID80991192
Molecular FormulaC10H15N3S
Molecular Weight209.32 g/mol
Exact Mass209.10
IUPAC Name2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine
SMILESCCSc1nc(C2CC2)nc(N)c1C
InChIInChI=1S/C10H15N3S/c1-3-14-10-6(2)8(11)12-9(13-10)7-4-5-7/h7H,3-5H2,1-2H3,(H2,11,12,13)
InChIKeyPYOQJAYLKDJKGT-UHFFFAOYSA-N
XLogP2.36
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.32
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)sulfanylpropane-1,2-diol
CID 80995079
2-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)sulfanyl-N,N-dimethylacetamide
CID 114235219
2-cyclopropyl-5-methyl-6-(oxetan-3-ylsulfanyl)pyrimidin-4-amine
CID 80995871
2-cyclopropyl-6-(2,5-dichlorophenyl)sulfanyl-5-methylpyrimidin-4-amine
CID 80990216
(2-cyclopropyl-5-methyl-6-propylsulfanylpyrimidin-4-yl)hydrazine
CID 81000764
6-ethyl-5-methyl-2-(4-propylcyclohexyl)pyrimidin-4-amine
CID 65402391
2-cyclobutyl-6-ethyl-5-methylpyrimidin-4-amine
CID 64985726
6-ethyl-5-methyl-2-(4-propan-2-ylcyclohexyl)pyrimidin-4-amine
CID 65402392
2-[(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
CID 80986308
2-cyclohexyl-6-ethyl-5-methylpyrimidin-4-amine
CID 63559786
2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylbutylsulfanyl)pyrimidin-4-amine
CID 107765745
4-N-(cyclobutylmethyl)-2-cyclopropyl-4-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 107403129

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine (CID 80991192) is 2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine is CCSc1nc(C2CC2)nc(N)c1C.
What is the InChIKey of 2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine?
The InChIKey is PYOQJAYLKDJKGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3S/c1-3-14-10-6(2)8(11)12-9(13-10)7-4-5-7/h7H,3-5H2,1-2H3,(H2,11,12,13).
What are the key properties of 2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine?
2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine has a molecular weight of 209.32 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-ethylsulfanyl-5-methylpyrimidin-4-amine is sourced from PubChem (CID 80991192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).