2,4-diethoxythieno[2,3-d]pyrimidine

C10H12N2O2S — CID 119087931

IUPAC2,4-diethoxythieno[2,3-d]pyrimidine
SMILESCCOc1nc(OCC)c2ccsc2n1
InChIInChI=1S/C10H12N2O2S/c1-3-13-8-7-5-6-15-9(7)12-10(11-8)14-4-2/h5-6H,3-4H2,1-2H3
InChIKeyQWZSDEUYUWJDNU-UHFFFAOYSA-N
MW224.28 g/mol
LogP2.49
Rot. Bonds4

About 2,4-diethoxythieno[2,3-d]pyrimidine

2,4-diethoxythieno[2,3-d]pyrimidine (PubChem CID 119087931) has the molecular formula C10H12N2O2S and a molecular weight of 224.28 g/mol. Its IUPAC name is 2,4-diethoxythieno[2,3-d]pyrimidine.

Molecular Properties

Compound Name2,4-diethoxythieno[2,3-d]pyrimidine
PubChem CID119087931
Molecular FormulaC10H12N2O2S
Molecular Weight224.28 g/mol
Exact Mass224.06
IUPAC Name2,4-diethoxythieno[2,3-d]pyrimidine
SMILESCCOc1nc(OCC)c2ccsc2n1
InChIInChI=1S/C10H12N2O2S/c1-3-13-8-7-5-6-15-9(7)12-10(11-8)14-4-2/h5-6H,3-4H2,1-2H3
InChIKeyQWZSDEUYUWJDNU-UHFFFAOYSA-N
XLogP2.49
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-4-ethoxythieno[2,3-d]pyrimidine
CID 103319715
2-chloro-4-(2-ethoxyethoxy)thieno[2,3-d]pyrimidine
CID 103319718
(4-butoxythieno[2,3-d]pyrimidin-2-yl)hydrazine
CID 103336122
4-(2-methylpropoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331483
2-methyl-4-phenylmethoxythieno[2,3-d]pyrimidine
CID 175578608
N-ethyl-4-pentoxythieno[2,3-d]pyrimidin-2-amine
CID 103331646
4-chloro-2-(2-ethoxypropan-2-yl)thieno[2,3-d]pyrimidine
CID 116701236
N-ethyl-4-phenylmethoxythieno[2,3-d]pyrimidin-2-amine
CID 103331360
[4-[(2-methylsulfanylthieno[2,3-d]pyrimidin-4-yl)oxymethyl]phenyl]methanol
CID 175578641
N-methyl-4-prop-2-enoxythieno[2,3-d]pyrimidin-2-amine
CID 103331220
[4-(2-methoxyethoxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336076
N-methyl-4-prop-2-ynoxythieno[2,3-d]pyrimidin-2-amine
CID 103331246

Frequently Asked Questions

What is the IUPAC name of 2,4-diethoxythieno[2,3-d]pyrimidine?
The IUPAC name of 2,4-diethoxythieno[2,3-d]pyrimidine (CID 119087931) is 2,4-diethoxythieno[2,3-d]pyrimidine.
What is the SMILES notation for 2,4-diethoxythieno[2,3-d]pyrimidine?
The canonical SMILES for 2,4-diethoxythieno[2,3-d]pyrimidine is CCOc1nc(OCC)c2ccsc2n1.
What is the InChIKey of 2,4-diethoxythieno[2,3-d]pyrimidine?
The InChIKey is QWZSDEUYUWJDNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2S/c1-3-13-8-7-5-6-15-9(7)12-10(11-8)14-4-2/h5-6H,3-4H2,1-2H3.
What are the key properties of 2,4-diethoxythieno[2,3-d]pyrimidine?
2,4-diethoxythieno[2,3-d]pyrimidine has a molecular weight of 224.28 g/mol, XLogP of 2.49, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diethoxythieno[2,3-d]pyrimidine is sourced from PubChem (CID 119087931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).