2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine

C10H16N4S — CID 105482392

IUPAC2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
SMILESCNC(C)Cc1nc(N)c2c(n1)CSC2
InChIInChI=1S/C10H16N4S/c1-6(12-2)3-9-13-8-5-15-4-7(8)10(11)14-9/h6,12H,3-5H2,1-2H3,(H2,11,13,14)
InChIKeySOASXLCGJHKDEY-UHFFFAOYSA-N
MW224.33 g/mol
LogP0.96
Rot. Bonds3

About 2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine

2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine (PubChem CID 105482392) has the molecular formula C10H16N4S and a molecular weight of 224.33 g/mol. Its IUPAC name is 2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
PubChem CID105482392
Molecular FormulaC10H16N4S
Molecular Weight224.33 g/mol
Exact Mass224.11
IUPAC Name2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
SMILESCNC(C)Cc1nc(N)c2c(n1)CSC2
InChIInChI=1S/C10H16N4S/c1-6(12-2)3-9-13-8-5-15-4-7(8)10(11)14-9/h6,12H,3-5H2,1-2H3,(H2,11,13,14)
InChIKeySOASXLCGJHKDEY-UHFFFAOYSA-N
XLogP0.96
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The IUPAC name of 2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine (CID 105482392) is 2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine is CNC(C)Cc1nc(N)c2c(n1)CSC2.
What is the InChIKey of 2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
The InChIKey is SOASXLCGJHKDEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4S/c1-6(12-2)3-9-13-8-5-15-4-7(8)10(11)14-9/h6,12H,3-5H2,1-2H3,(H2,11,13,14).
What are the key properties of 2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine?
2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine has a molecular weight of 224.33 g/mol, XLogP of 0.96, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methylamino)propyl]-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 105482392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).