2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine

C10H17N3S — CID 80937028

IUPAC2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine
SMILESCCCSc1cc(NC)nc(CC)n1
InChIInChI=1S/C10H17N3S/c1-4-6-14-10-7-9(11-3)12-8(5-2)13-10/h7H,4-6H2,1-3H3,(H,11,12,13)
InChIKeyLUTKYIXNFNOGQZ-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.58
Rot. Bonds5

About 2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine

2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine (PubChem CID 80937028) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine
PubChem CID80937028
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine
SMILESCCCSc1cc(NC)nc(CC)n1
InChIInChI=1S/C10H17N3S/c1-4-6-14-10-7-9(11-3)12-8(5-2)13-10/h7H,4-6H2,1-3H3,(H,11,12,13)
InChIKeyLUTKYIXNFNOGQZ-UHFFFAOYSA-N
XLogP2.58
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-methylsulfanyl-6-propylsulfanylpyrimidin-4-amine
CID 80888612
N-ethyl-2-propyl-6-propylsulfanylpyrimidin-4-amine
CID 80947510
N-methyl-2-phenyl-6-propylsulfanylpyrimidin-4-amine
CID 112559927
N-methyl-6-(2-methylbutylsulfanyl)-2-propylpyrimidin-4-amine
CID 107765749
2-ethyl-N,6-dimethylpyrimidin-4-amine
CID 62192654
2-ethyl-N-methyl-6-naphthalen-2-ylsulfanylpyrimidin-4-amine
CID 80939312
4-N-methyl-6-pentylsulfanylpyrimidine-2,4-diamine
CID 107765242
2-ethyl-N-methyl-6-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyrimidin-4-amine
CID 80937261
methyl 3-[2-ethyl-6-(propylamino)pyrimidin-4-yl]sulfanylpropanoate
CID 80937339
2-ethyl-N-methyl-6-[(2-methyl-1,2,4-triazol-3-yl)sulfanyl]pyrimidin-4-amine
CID 104605016
2-ethyl-N-methyl-6-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]pyrimidin-4-amine
CID 80937646
2-ethyl-N-methyl-6-(4-methylsulfonylphenyl)sulfanylpyrimidin-4-amine
CID 80939328

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine?
The IUPAC name of 2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine (CID 80937028) is 2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine?
The canonical SMILES for 2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine is CCCSc1cc(NC)nc(CC)n1.
What is the InChIKey of 2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine?
The InChIKey is LUTKYIXNFNOGQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-4-6-14-10-7-9(11-3)12-8(5-2)13-10/h7H,4-6H2,1-3H3,(H,11,12,13).
What are the key properties of 2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine?
2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine has a molecular weight of 211.33 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methyl-6-propylsulfanylpyrimidin-4-amine is sourced from PubChem (CID 80937028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).