5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine

C15H21N3S — CID 61025564

IUPAC5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCc1sc2nc(C3CCCC(C)C3)nc(N)c2c1C
InChIInChI=1S/C15H21N3S/c1-8-5-4-6-11(7-8)14-17-13(16)12-9(2)10(3)19-15(12)18-14/h8,11H,4-7H2,1-3H3,(H2,16,17,18)
InChIKeyFQFSSIMBUJWJIR-UHFFFAOYSA-N
MW275.42 g/mol
LogP4.18
Rot. Bonds1

About 5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine

5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 61025564) has the molecular formula C15H21N3S and a molecular weight of 275.42 g/mol. Its IUPAC name is 5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID61025564
Molecular FormulaC15H21N3S
Molecular Weight275.42 g/mol
Exact Mass275.15
IUPAC Name5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCc1sc2nc(C3CCCC(C)C3)nc(N)c2c1C
InChIInChI=1S/C15H21N3S/c1-8-5-4-6-11(7-8)14-17-13(16)12-9(2)10(3)19-15(12)18-14/h8,11H,4-7H2,1-3H3,(H2,16,17,18)
InChIKeyFQFSSIMBUJWJIR-UHFFFAOYSA-N
XLogP4.18
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 61025320
5,6-dimethyl-2-(2-methylcyclopropyl)thieno[2,3-d]pyrimidin-4-amine
CID 65419572
(2-cyclohexyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)hydrazine
CID 62250283
(2-cycloheptyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)hydrazine
CID 65399665
4,6-dichloro-5-methyl-2-(3-methylcyclohexyl)pyrimidine
CID 63611976
2-cyclooctyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
CID 80611910
5-bromo-2-(3-methylcyclohexyl)-6-propan-2-ylpyrimidin-4-amine
CID 66301275
5,6-dimethyl-2-[(4-methylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 60703001
2-(cyclopentylsulfanylmethyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 60707023
5,6-dimethyl-2-(4-methylthiomorpholin-3-yl)thieno[2,3-d]pyrimidin-4-amine
CID 106445664
[1-[(4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)methyl]-6-methylpiperidin-2-yl]methanol
CID 110016996
2-[[cyclobutylmethyl(ethyl)amino]methyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 107401404

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine (CID 61025564) is 5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine is Cc1sc2nc(C3CCCC(C)C3)nc(N)c2c1C.
What is the InChIKey of 5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is FQFSSIMBUJWJIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3S/c1-8-5-4-6-11(7-8)14-17-13(16)12-9(2)10(3)19-15(12)18-14/h8,11H,4-7H2,1-3H3,(H2,16,17,18).
What are the key properties of 5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine?
5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 275.42 g/mol, XLogP of 4.18, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 61025564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).