2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine

C17H15N5OS — CID 68608634

IUPAC2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine
SMILESCC(Cc1ccccn1)c1cc2c(N)nc(-c3ncco3)nc2s1
InChIInChI=1S/C17H15N5OS/c1-10(8-11-4-2-3-5-19-11)13-9-12-14(18)21-15(22-17(12)24-13)16-20-6-7-23-16/h2-7,9-10H,8H2,1H3,(H2,18,21,22)
InChIKeyMEFPBVKMZQFFPP-UHFFFAOYSA-N
MW337.41 g/mol
LogP3.67
Rot. Bonds4

About 2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine

2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 68608634) has the molecular formula C17H15N5OS and a molecular weight of 337.41 g/mol. Its IUPAC name is 2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID68608634
Molecular FormulaC17H15N5OS
Molecular Weight337.41 g/mol
Exact Mass337.10
IUPAC Name2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine
SMILESCC(Cc1ccccn1)c1cc2c(N)nc(-c3ncco3)nc2s1
InChIInChI=1S/C17H15N5OS/c1-10(8-11-4-2-3-5-19-11)13-9-12-14(18)21-15(22-17(12)24-13)16-20-6-7-23-16/h2-7,9-10H,8H2,1H3,(H2,18,21,22)
InChIKeyMEFPBVKMZQFFPP-UHFFFAOYSA-N
XLogP3.67
TPSA90.72 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.41
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine (CID 68608634) is 2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine is CC(Cc1ccccn1)c1cc2c(N)nc(-c3ncco3)nc2s1.
What is the InChIKey of 2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is MEFPBVKMZQFFPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5OS/c1-10(8-11-4-2-3-5-19-11)13-9-12-14(18)21-15(22-17(12)24-13)16-20-6-7-23-16/h2-7,9-10H,8H2,1H3,(H2,18,21,22).
What are the key properties of 2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine?
2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 337.41 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-oxazol-2-yl)-6-(1-pyridin-2-ylpropan-2-yl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 68608634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).