3-thiophen-2-yl-5H-pyrido[3,2-b]indole

C15H10N2S — CID 11831842

IUPAC3-thiophen-2-yl-5H-pyrido[3,2-b]indole
SMILESc1csc(-c2cnc3c(c2)[nH]c2ccccc23)c1
InChIInChI=1S/C15H10N2S/c1-2-5-12-11(4-1)15-13(17-12)8-10(9-16-15)14-6-3-7-18-14/h1-9,17H
InChIKeyVRNACAMCJRXKPI-UHFFFAOYSA-N
MW250.33 g/mol
LogP4.44
Rot. Bonds1

About 3-thiophen-2-yl-5H-pyrido[3,2-b]indole

3-thiophen-2-yl-5H-pyrido[3,2-b]indole (PubChem CID 11831842) has the molecular formula C15H10N2S and a molecular weight of 250.33 g/mol. Its IUPAC name is 3-thiophen-2-yl-5H-pyrido[3,2-b]indole.

Molecular Properties

Compound Name3-thiophen-2-yl-5H-pyrido[3,2-b]indole
PubChem CID11831842
Molecular FormulaC15H10N2S
Molecular Weight250.33 g/mol
Exact Mass250.06
IUPAC Name3-thiophen-2-yl-5H-pyrido[3,2-b]indole
SMILESc1csc(-c2cnc3c(c2)[nH]c2ccccc23)c1
InChIInChI=1S/C15H10N2S/c1-2-5-12-11(4-1)15-13(17-12)8-10(9-16-15)14-6-3-7-18-14/h1-9,17H
InChIKeyVRNACAMCJRXKPI-UHFFFAOYSA-N
XLogP4.44
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.33
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-thiophen-2-yl-5H-pyrido[3,2-b]indole?
The IUPAC name of 3-thiophen-2-yl-5H-pyrido[3,2-b]indole (CID 11831842) is 3-thiophen-2-yl-5H-pyrido[3,2-b]indole.
What is the SMILES notation for 3-thiophen-2-yl-5H-pyrido[3,2-b]indole?
The canonical SMILES for 3-thiophen-2-yl-5H-pyrido[3,2-b]indole is c1csc(-c2cnc3c(c2)[nH]c2ccccc23)c1.
What is the InChIKey of 3-thiophen-2-yl-5H-pyrido[3,2-b]indole?
The InChIKey is VRNACAMCJRXKPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2S/c1-2-5-12-11(4-1)15-13(17-12)8-10(9-16-15)14-6-3-7-18-14/h1-9,17H.
What are the key properties of 3-thiophen-2-yl-5H-pyrido[3,2-b]indole?
3-thiophen-2-yl-5H-pyrido[3,2-b]indole has a molecular weight of 250.33 g/mol, XLogP of 4.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-thiophen-2-yl-5H-pyrido[3,2-b]indole is sourced from PubChem (CID 11831842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).