6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine

C15H20N4S — CID 102927033

IUPAC6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine
SMILESCCc1nc(NC)c(C)c(Sc2cc(C)cc(C)n2)n1
InChIInChI=1S/C15H20N4S/c1-6-12-18-14(16-5)11(4)15(19-12)20-13-8-9(2)7-10(3)17-13/h7-8H,6H2,1-5H3,(H,16,18,19)
InChIKeyPCPWNVAEIKQXHD-UHFFFAOYSA-N
MW288.42 g/mol
LogP3.55
Rot. Bonds4

About 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine

6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine (PubChem CID 102927033) has the molecular formula C15H20N4S and a molecular weight of 288.42 g/mol. Its IUPAC name is 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine
PubChem CID102927033
Molecular FormulaC15H20N4S
Molecular Weight288.42 g/mol
Exact Mass288.14
IUPAC Name6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine
SMILESCCc1nc(NC)c(C)c(Sc2cc(C)cc(C)n2)n1
InChIInChI=1S/C15H20N4S/c1-6-12-18-14(16-5)11(4)15(19-12)20-13-8-9(2)7-10(3)17-13/h7-8H,6H2,1-5H3,(H,16,18,19)
InChIKeyPCPWNVAEIKQXHD-UHFFFAOYSA-N
XLogP3.55
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.42
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine with MolForge

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Related Compounds

2-ethyl-N,5-dimethyl-6-(4,5,6-trimethylpyrimidin-2-yl)sulfanylpyrimidin-4-amine
CID 80995265
3,5-dichloro-6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-N-methylpyridin-2-amine
CID 102926978
6-(3,4-difluorophenyl)sulfanyl-2-ethyl-N,5-dimethylpyrimidin-4-amine
CID 80990085
6-(3,5-dimethylphenyl)-2-ethyl-N,5-dimethylpyrimidin-4-amine
CID 80975562
6-(3-bromophenyl)sulfanyl-2-ethyl-N,5-dimethylpyrimidin-4-amine
CID 80994557
2-ethyl-N,5-dimethyl-6-propan-2-ylsulfanylpyrimidin-4-amine
CID 80990351
2-ethyl-N,5-dimethyl-6-(3-methylphenyl)pyrimidin-4-amine
CID 80975057
N,2-diethyl-5-methyl-6-(4-methylphenyl)sulfanylpyrimidin-4-amine
CID 80991208
2-ethyl-6-(2-methoxy-4,6-dimethylphenyl)-N,5-dimethylpyrimidin-4-amine
CID 106681515
6-(2,5-dimethylpyrazol-3-yl)sulfanyl-N,2-diethyl-5-methylpyrimidin-4-amine
CID 80995753
2-ethyl-6-(3-methoxypropylsulfanyl)-N,5-dimethylpyrimidin-4-amine
CID 80994572
2-[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]sulfanylpyrimidine-4,6-diamine
CID 80990475

Frequently Asked Questions

What is the IUPAC name of 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine?
The IUPAC name of 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine (CID 102927033) is 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine?
The canonical SMILES for 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine is CCc1nc(NC)c(C)c(Sc2cc(C)cc(C)n2)n1.
What is the InChIKey of 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine?
The InChIKey is PCPWNVAEIKQXHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4S/c1-6-12-18-14(16-5)11(4)15(19-12)20-13-8-9(2)7-10(3)17-13/h7-8H,6H2,1-5H3,(H,16,18,19).
What are the key properties of 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine?
6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine has a molecular weight of 288.42 g/mol, XLogP of 3.55, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4,6-dimethyl-2-pyridinyl)sulfanyl]-2-ethyl-N,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 102927033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).