2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine

C14H11F2N3S — CID 63615139

IUPAC2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine
SMILESCCc1cc2c(N)nc(-c3ccc(F)c(F)c3)nc2s1
InChIInChI=1S/C14H11F2N3S/c1-2-8-6-9-12(17)18-13(19-14(9)20-8)7-3-4-10(15)11(16)5-7/h3-6H,2H2,1H3,(H2,17,18,19)
InChIKeyGCIWZVCOKYKFAJ-UHFFFAOYSA-N
MW291.33 g/mol
LogP3.78
Rot. Bonds2

About 2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine

2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 63615139) has the molecular formula C14H11F2N3S and a molecular weight of 291.33 g/mol. Its IUPAC name is 2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine
PubChem CID63615139
Molecular FormulaC14H11F2N3S
Molecular Weight291.33 g/mol
Exact Mass291.06
IUPAC Name2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine
SMILESCCc1cc2c(N)nc(-c3ccc(F)c(F)c3)nc2s1
InChIInChI=1S/C14H11F2N3S/c1-2-8-6-9-12(17)18-13(19-14(9)20-8)7-3-4-10(15)11(16)5-7/h3-6H,2H2,1H3,(H2,17,18,19)
InChIKeyGCIWZVCOKYKFAJ-UHFFFAOYSA-N
XLogP3.78
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-ethyl-2-(4-methylsulfanylphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 106849494
6-ethyl-2-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-amine
CID 63614813
6-ethyl-2-(2-fluorophenyl)thieno[2,3-d]pyrimidin-4-amine
CID 63614303
6-ethyl-2-(4-methyl-1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 141266147
6-ethyl-2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 104806564
[6-ethyl-2-(4-methylsulfanylphenyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 106849598
ethane;2-phenyl-6-(2-phenylethyl)thieno[2,3-d]pyrimidin-4-amine
CID 143976514
5-bromo-2-(3,4-difluorophenyl)-6-methylpyrimidin-4-amine
CID 66304664
4-chloro-2-(2,5-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidine
CID 63663426
6-[(6-chloro-3-pyridinyl)methyl]-2-(3-fluorophenyl)thieno[2,3-d]pyrimidin-4-amine
CID 45275186
2-cyclopentyl-6-ethylthieno[2,3-d]pyrimidin-4-amine
CID 55250109
4-(2,4-difluorophenyl)sulfanyl-6-ethylthieno[2,3-d]pyrimidin-2-amine
CID 103334079

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine (CID 63615139) is 2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine is CCc1cc2c(N)nc(-c3ccc(F)c(F)c3)nc2s1.
What is the InChIKey of 2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is GCIWZVCOKYKFAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2N3S/c1-2-8-6-9-12(17)18-13(19-14(9)20-8)7-3-4-10(15)11(16)5-7/h3-6H,2H2,1H3,(H2,17,18,19).
What are the key properties of 2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine?
2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 291.33 g/mol, XLogP of 3.78, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-difluorophenyl)-6-ethylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 63615139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).