N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine

C17H14N6OS — CID 166320046

IUPACN-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine
SMILESc1ccc(-c2nc(NCc3nnc(C4CC4)o3)c3ccsc3n2)nc1
InChIInChI=1S/C17H14N6OS/c1-2-7-18-12(3-1)15-20-14(11-6-8-25-17(11)21-15)19-9-13-22-23-16(24-13)10-4-5-10/h1-3,6-8,10H,4-5,9H2,(H,19,20,21)
InChIKeyOCOLQWVBEBBJHH-UHFFFAOYSA-N
MW350.41 g/mol
LogP3.63
Rot. Bonds5

About N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine

N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 166320046) has the molecular formula C17H14N6OS and a molecular weight of 350.41 g/mol. Its IUPAC name is N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine
PubChem CID166320046
Molecular FormulaC17H14N6OS
Molecular Weight350.41 g/mol
Exact Mass350.09
IUPAC NameN-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine
SMILESc1ccc(-c2nc(NCc3nnc(C4CC4)o3)c3ccsc3n2)nc1
InChIInChI=1S/C17H14N6OS/c1-2-7-18-12(3-1)15-20-14(11-6-8-25-17(11)21-15)19-9-13-22-23-16(24-13)10-4-5-10/h1-3,6-8,10H,4-5,9H2,(H,19,20,21)
InChIKeyOCOLQWVBEBBJHH-UHFFFAOYSA-N
XLogP3.63
TPSA89.62 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.41
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine with MolForge

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Related Compounds

N-(oxan-4-ylmethyl)-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine
CID 166245983
N-[(3-cyclobutyl-1,2-oxazol-4-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine
CID 166320075
N-cyclopropyl-2-[(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)amino]acetamide
CID 166245959
N-[[3-[(2-fluorophenyl)methyl]-1,2,4-oxadiazol-5-yl]methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine
CID 166320074
3-[(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)amino]propan-1-ol
CID 166320094
N-[(4-methyloxan-4-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine
CID 166246019
[2-[(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)amino]-1-bicyclo[3.1.0]hexanyl]methanol
CID 166310130
N-(4,4-dimethylpyrrolidin-3-yl)-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine
CID 166257983
N-[(2,3-dimethyl-1,1-dioxo-1,2-thiazolidin-3-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine
CID 166278916
(2S)-3-methyl-2-[(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)amino]butanamide
CID 138020227
6-(cyclopropylamino)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)pyridine-3-carboxamide
CID 167992083
N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-methylpyrimidin-4-amine
CID 167765215

Frequently Asked Questions

What is the IUPAC name of N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine (CID 166320046) is N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine is c1ccc(-c2nc(NCc3nnc(C4CC4)o3)c3ccsc3n2)nc1.
What is the InChIKey of N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is OCOLQWVBEBBJHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N6OS/c1-2-7-18-12(3-1)15-20-14(11-6-8-25-17(11)21-15)19-9-13-22-23-16(24-13)10-4-5-10/h1-3,6-8,10H,4-5,9H2,(H,19,20,21).
What are the key properties of N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine?
N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 350.41 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 166320046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).