N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine

C13H14N4S — CID 83190550

IUPACN-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
SMILESCNc1nc(-c2cccc(C)n2)nc2c1CSC2
InChIInChI=1S/C13H14N4S/c1-8-4-3-5-10(15-8)13-16-11-7-18-6-9(11)12(14-2)17-13/h3-5H,6-7H2,1-2H3,(H,14,16,17)
InChIKeyDENFHERGLNVPJK-UHFFFAOYSA-N
MW258.35 g/mol
LogP2.64
Rot. Bonds2

About N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine

N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine (PubChem CID 83190550) has the molecular formula C13H14N4S and a molecular weight of 258.35 g/mol. Its IUPAC name is N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
PubChem CID83190550
Molecular FormulaC13H14N4S
Molecular Weight258.35 g/mol
Exact Mass258.09
IUPAC NameN-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
SMILESCNc1nc(-c2cccc(C)n2)nc2c1CSC2
InChIInChI=1S/C13H14N4S/c1-8-4-3-5-10(15-8)13-16-11-7-18-6-9(11)12(14-2)17-13/h3-5H,6-7H2,1-2H3,(H,14,16,17)
InChIKeyDENFHERGLNVPJK-UHFFFAOYSA-N
XLogP2.64
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The IUPAC name of N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine (CID 83190550) is N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The canonical SMILES for N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine is CNc1nc(-c2cccc(C)n2)nc2c1CSC2.
What is the InChIKey of N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The InChIKey is DENFHERGLNVPJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4S/c1-8-4-3-5-10(15-8)13-16-11-7-18-6-9(11)12(14-2)17-13/h3-5H,6-7H2,1-2H3,(H,14,16,17).
What are the key properties of N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine has a molecular weight of 258.35 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(6-methyl-2-pyridinyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 83190550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).