N-cyclopropylthieno[2,3-d]pyrimidin-4-amine

C9H9N3S — CID 13038297

IUPACN-cyclopropylthieno[2,3-d]pyrimidin-4-amine
SMILESc1nc(NC2CC2)c2ccsc2n1
InChIInChI=1S/C9H9N3S/c1-2-6(1)12-8-7-3-4-13-9(7)11-5-10-8/h3-6H,1-2H2,(H,10,11,12)
InChIKeyWUKKJPSLDUVLPZ-UHFFFAOYSA-N
MW191.26 g/mol
LogP2.27
Rot. Bonds2

About N-cyclopropylthieno[2,3-d]pyrimidin-4-amine

N-cyclopropylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 13038297) has the molecular formula C9H9N3S and a molecular weight of 191.26 g/mol. Its IUPAC name is N-cyclopropylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopropylthieno[2,3-d]pyrimidin-4-amine
PubChem CID13038297
Molecular FormulaC9H9N3S
Molecular Weight191.26 g/mol
Exact Mass191.05
IUPAC NameN-cyclopropylthieno[2,3-d]pyrimidin-4-amine
SMILESc1nc(NC2CC2)c2ccsc2n1
InChIInChI=1S/C9H9N3S/c1-2-6(1)12-8-7-3-4-13-9(7)11-5-10-8/h3-6H,1-2H2,(H,10,11,12)
InChIKeyWUKKJPSLDUVLPZ-UHFFFAOYSA-N
XLogP2.27
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.26
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-cyclopropylthieno[2,3-d]pyrimidin-4-amine (CID 13038297) is N-cyclopropylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-cyclopropylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-cyclopropylthieno[2,3-d]pyrimidin-4-amine is c1nc(NC2CC2)c2ccsc2n1.
What is the InChIKey of N-cyclopropylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is WUKKJPSLDUVLPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3S/c1-2-6(1)12-8-7-3-4-13-9(7)11-5-10-8/h3-6H,1-2H2,(H,10,11,12).
What are the key properties of N-cyclopropylthieno[2,3-d]pyrimidin-4-amine?
N-cyclopropylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 191.26 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 13038297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).