2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine

C17H15N5OS — CID 68605448

IUPAC2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine
SMILESNc1nc(-c2cnco2)nc2sc(CCCc3ccccn3)cc12
InChIInChI=1S/C17H15N5OS/c18-15-13-8-12(6-3-5-11-4-1-2-7-20-11)24-17(13)22-16(21-15)14-9-19-10-23-14/h1-2,4,7-10H,3,5-6H2,(H2,18,21,22)
InChIKeyHBMVFXUBXUMATR-UHFFFAOYSA-N
MW337.41 g/mol
LogP3.50
Rot. Bonds5

About 2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine

2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 68605448) has the molecular formula C17H15N5OS and a molecular weight of 337.41 g/mol. Its IUPAC name is 2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID68605448
Molecular FormulaC17H15N5OS
Molecular Weight337.41 g/mol
Exact Mass337.10
IUPAC Name2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine
SMILESNc1nc(-c2cnco2)nc2sc(CCCc3ccccn3)cc12
InChIInChI=1S/C17H15N5OS/c18-15-13-8-12(6-3-5-11-4-1-2-7-20-11)24-17(13)22-16(21-15)14-9-19-10-23-14/h1-2,4,7-10H,3,5-6H2,(H2,18,21,22)
InChIKeyHBMVFXUBXUMATR-UHFFFAOYSA-N
XLogP3.50
TPSA90.72 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.41
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-Benzyl-2-oxazol-5-yl-thieno[2,3-d]pyrimidin-4-ylamine
CID 45275821
6-Benzyl-2-(1,3-oxazol-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 71602915
6-(2,5-Dihydropyrrol-1-ylmethyl)-2-(1,3-oxazol-4-yl)thieno[2,3-d]pyrimidin-4-amine
CID 45278622
6-(3,6-dihydro-2H-pyridin-1-ylmethyl)-2-(1,3-oxazol-4-yl)thieno[2,3-d]pyrimidin-4-amine
CID 45278623
6-(Morpholin-4-ylmethyl)-2-(1,3-oxazol-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 45278701
6-(2,5-Dihydropyrrol-1-ylmethyl)-2-(1,3-oxazol-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 90668275
6-(3,6-dihydro-2H-pyridin-1-ylmethyl)-2-(1,3-oxazol-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 90668276
[1]Benzothieno[3,2-e][1,3]oxazolo[3,2-a]pyrimidin-11-ium bromide
CID 129738490
4-(difluoromethyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-1,3-oxazole-5-carboxamide
CID 167897284
N-[2-(1,3-benzothiazol-6-yl)pyrimidin-4-yl]-5-cyclopropyl-1,3-oxazol-4-amine
CID 10308733
2-(1,3-Oxazol-2-yl)-6-(pyrazin-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 45274516
2-(1,3-Oxazol-2-yl)-6-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 45274517

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine (CID 68605448) is 2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine is Nc1nc(-c2cnco2)nc2sc(CCCc3ccccn3)cc12.
What is the InChIKey of 2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is HBMVFXUBXUMATR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5OS/c18-15-13-8-12(6-3-5-11-4-1-2-7-20-11)24-17(13)22-16(21-15)14-9-19-10-23-14/h1-2,4,7-10H,3,5-6H2,(H2,18,21,22).
What are the key properties of 2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine?
2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 337.41 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-oxazol-5-yl)-6-(3-pyridin-2-ylpropyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 68605448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).