3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane

C10H13BrN2S — CID 142968737

IUPAC3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane
SMILESCC.Cc1cnc(N)c2c(Br)csc12
InChIInChI=1S/C8H7BrN2S.C2H6/c1-4-2-11-8(10)6-5(9)3-12-7(4)6;1-2/h2-3H,1H3,(H2,10,11);1-2H3
InChIKeySADSRQPGGIUEHK-UHFFFAOYSA-N
MW273.20 g/mol
LogP3.98
Rot. Bonds

About 3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane

3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane (PubChem CID 142968737) has the molecular formula C10H13BrN2S and a molecular weight of 273.20 g/mol. Its IUPAC name is 3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane.

Molecular Properties

Compound Name3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane
PubChem CID142968737
Molecular FormulaC10H13BrN2S
Molecular Weight273.20 g/mol
Exact Mass272.00
IUPAC Name3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane
SMILESCC.Cc1cnc(N)c2c(Br)csc12
InChIInChI=1S/C8H7BrN2S.C2H6/c1-4-2-11-8(10)6-5(9)3-12-7(4)6;1-2/h2-3H,1H3,(H2,10,11);1-2H3
InChIKeySADSRQPGGIUEHK-UHFFFAOYSA-N
XLogP3.98
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.20
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane?
The IUPAC name of 3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane (CID 142968737) is 3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane.
What is the SMILES notation for 3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane?
The canonical SMILES for 3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane is CC.Cc1cnc(N)c2c(Br)csc12.
What is the InChIKey of 3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane?
The InChIKey is SADSRQPGGIUEHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7BrN2S.C2H6/c1-4-2-11-8(10)6-5(9)3-12-7(4)6;1-2/h2-3H,1H3,(H2,10,11);1-2H3.
What are the key properties of 3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane?
3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane has a molecular weight of 273.20 g/mol, XLogP of 3.98, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-7-methylthieno[3,2-c]pyridin-4-amine;ethane is sourced from PubChem (CID 142968737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).