2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide

C19H15N5OS — CID 133367589

IUPAC2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide
SMILESO=C(CNc1ncnc2sc(-c3ccccc3)cc12)Nc1ccccn1
InChIInChI=1S/C19H15N5OS/c25-17(24-16-8-4-5-9-20-16)11-21-18-14-10-15(13-6-2-1-3-7-13)26-19(14)23-12-22-18/h1-10,12H,11H2,(H,20,24,25)(H,21,22,23)
InChIKeySRGSRGVRDFUDBI-UHFFFAOYSA-N
MW361.43 g/mol
LogP3.80
Rot. Bonds5

About 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide

2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide (PubChem CID 133367589) has the molecular formula C19H15N5OS and a molecular weight of 361.43 g/mol. Its IUPAC name is 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide.

Molecular Properties

Compound Name2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide
PubChem CID133367589
Molecular FormulaC19H15N5OS
Molecular Weight361.43 g/mol
Exact Mass361.10
IUPAC Name2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide
SMILESO=C(CNc1ncnc2sc(-c3ccccc3)cc12)Nc1ccccn1
InChIInChI=1S/C19H15N5OS/c25-17(24-16-8-4-5-9-20-16)11-21-18-14-10-15(13-6-2-1-3-7-13)26-19(14)23-12-22-18/h1-10,12H,11H2,(H,20,24,25)(H,21,22,23)
InChIKeySRGSRGVRDFUDBI-UHFFFAOYSA-N
XLogP3.80
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.43
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide?
The IUPAC name of 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide (CID 133367589) is 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide.
What is the SMILES notation for 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide?
The canonical SMILES for 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide is O=C(CNc1ncnc2sc(-c3ccccc3)cc12)Nc1ccccn1.
What is the InChIKey of 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide?
The InChIKey is SRGSRGVRDFUDBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5OS/c25-17(24-16-8-4-5-9-20-16)11-21-18-14-10-15(13-6-2-1-3-7-13)26-19(14)23-12-22-18/h1-10,12H,11H2,(H,20,24,25)(H,21,22,23).
What are the key properties of 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide?
2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide has a molecular weight of 361.43 g/mol, XLogP of 3.80, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]-N-pyridin-2-ylacetamide is sourced from PubChem (CID 133367589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).