4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine

C13H10ClN3OS — CID 133418139

IUPAC4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine
SMILESCCc1nc(Oc2cncc(Cl)c2)c2ccsc2n1
InChIInChI=1S/C13H10ClN3OS/c1-2-11-16-12(10-3-4-19-13(10)17-11)18-9-5-8(14)6-15-7-9/h3-7H,2H2,1H3
InChIKeyVENWELSLVMJIRP-UHFFFAOYSA-N
MW291.76 g/mol
LogP4.09
Rot. Bonds3

About 4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine

4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine (PubChem CID 133418139) has the molecular formula C13H10ClN3OS and a molecular weight of 291.76 g/mol. Its IUPAC name is 4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine.

Molecular Properties

Compound Name4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine
PubChem CID133418139
Molecular FormulaC13H10ClN3OS
Molecular Weight291.76 g/mol
Exact Mass291.02
IUPAC Name4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine
SMILESCCc1nc(Oc2cncc(Cl)c2)c2ccsc2n1
InChIInChI=1S/C13H10ClN3OS/c1-2-11-16-12(10-3-4-19-13(10)17-11)18-9-5-8(14)6-15-7-9/h3-7H,2H2,1H3
InChIKeyVENWELSLVMJIRP-UHFFFAOYSA-N
XLogP4.09
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.76
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-4-[(5-chloro-3-pyridinyl)oxy]-6-ethylthieno[2,3-d]pyrimidine
CID 103320133
4-[(5-bromo-3-pyridinyl)oxy]thieno[2,3-d]pyrimidin-2-amine
CID 103332787
2-(2-ethylthieno[2,3-d]pyrimidin-4-yl)oxy-6-fluorobenzonitrile
CID 133405453
2-chloro-4-ethoxythieno[2,3-d]pyrimidine
CID 103319715
4-[(5-chloro-3-pyridinyl)oxy]-N-ethylquinazolin-2-amine
CID 80870580
3,5-bis[(5-chloro-3-pyridinyl)oxy]pyridine
CID 102468102
4-(4-propylphenoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103332428
4-[(5-chloro-3-pyridinyl)oxy]-N-methylquinazolin-2-amine
CID 80877516
4-(3,5-difluorophenoxy)-N-ethylthieno[2,3-d]pyrimidin-2-amine
CID 103332454
6-chloro-2-[(5-chloro-3-pyridinyl)oxy]pyridin-3-amine
CID 115474542
4-[(2-ethyl-6-methyl-3-pyridinyl)oxy]thieno[2,3-d]pyrimidin-2-amine
CID 103333669
2,4-diethoxythieno[2,3-d]pyrimidine
CID 119087931

Frequently Asked Questions

What is the IUPAC name of 4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine?
The IUPAC name of 4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine (CID 133418139) is 4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine.
What is the SMILES notation for 4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine?
The canonical SMILES for 4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine is CCc1nc(Oc2cncc(Cl)c2)c2ccsc2n1.
What is the InChIKey of 4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine?
The InChIKey is VENWELSLVMJIRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClN3OS/c1-2-11-16-12(10-3-4-19-13(10)17-11)18-9-5-8(14)6-15-7-9/h3-7H,2H2,1H3.
What are the key properties of 4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine?
4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine has a molecular weight of 291.76 g/mol, XLogP of 4.09, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-chloro-3-pyridinyl)oxy]-2-ethylthieno[2,3-d]pyrimidine is sourced from PubChem (CID 133418139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).