2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine

C13H17N3S — CID 61025320

IUPAC2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1sc2nc(C3CCCC3)nc(N)c2c1C
InChIInChI=1S/C13H17N3S/c1-7-8(2)17-13-10(7)11(14)15-12(16-13)9-5-3-4-6-9/h9H,3-6H2,1-2H3,(H2,14,15,16)
InChIKeyLRDXSYSJFBESKF-UHFFFAOYSA-N
MW247.37 g/mol
LogP3.55
Rot. Bonds1

About 2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine

2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 61025320) has the molecular formula C13H17N3S and a molecular weight of 247.37 g/mol. Its IUPAC name is 2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
PubChem CID61025320
Molecular FormulaC13H17N3S
Molecular Weight247.37 g/mol
Exact Mass247.11
IUPAC Name2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1sc2nc(C3CCCC3)nc(N)c2c1C
InChIInChI=1S/C13H17N3S/c1-7-8(2)17-13-10(7)11(14)15-12(16-13)9-5-3-4-6-9/h9H,3-6H2,1-2H3,(H2,14,15,16)
InChIKeyLRDXSYSJFBESKF-UHFFFAOYSA-N
XLogP3.55
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.37
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5,6-dimethyl-2-(3-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine
CID 61025564
(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
2-cyclooctyl-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
CID 80611910
5,6-dimethyl-2-(2-methylcyclopropyl)thieno[2,3-d]pyrimidin-4-amine
CID 65419572
2-(cyclopentylsulfanylmethyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 60707023
2-(4,4-dimethylcyclohexyl)-N,5,6-trimethylthieno[2,3-d]pyrimidin-4-amine
CID 65391851
5,6-dimethyl-2-(4-methylthiomorpholin-3-yl)thieno[2,3-d]pyrimidin-4-amine
CID 106445664
2-cyclopropyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine
CID 55038211
2-(chloromethyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 9115252
1-[(4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)methyl]piperidin-4-ol
CID 60703002
5,6-dimethyl-2-[(4-methylpiperidin-1-yl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 60703001

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine (CID 61025320) is 2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine is Cc1sc2nc(C3CCCC3)nc(N)c2c1C.
What is the InChIKey of 2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is LRDXSYSJFBESKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3S/c1-7-8(2)17-13-10(7)11(14)15-12(16-13)9-5-3-4-6-9/h9H,3-6H2,1-2H3,(H2,14,15,16).
What are the key properties of 2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine?
2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 247.37 g/mol, XLogP of 3.55, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 61025320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).