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

C15H10N2S — CID 10562637

IUPAC4-thiophen-2-yl-5H-pyrido[3,2-b]indole
SMILESc1csc(-c2ccnc3c2[nH]c2ccccc23)c1
InChIInChI=1S/C15H10N2S/c1-2-5-12-10(4-1)14-15(17-12)11(7-8-16-14)13-6-3-9-18-13/h1-9,17H
InChIKeyVKEQYPHNKYFWFH-UHFFFAOYSA-N
MW250.33 g/mol
LogP4.44
Rot. Bonds1

About 4-thiophen-2-yl-5H-pyrido[3,2-b]indole

4-thiophen-2-yl-5H-pyrido[3,2-b]indole (PubChem CID 10562637) has the molecular formula C15H10N2S and a molecular weight of 250.33 g/mol. Its IUPAC name is 4-thiophen-2-yl-5H-pyrido[3,2-b]indole.

Molecular Properties

Compound Name4-thiophen-2-yl-5H-pyrido[3,2-b]indole
PubChem CID10562637
Molecular FormulaC15H10N2S
Molecular Weight250.33 g/mol
Exact Mass250.06
IUPAC Name4-thiophen-2-yl-5H-pyrido[3,2-b]indole
SMILESc1csc(-c2ccnc3c2[nH]c2ccccc23)c1
InChIInChI=1S/C15H10N2S/c1-2-5-12-10(4-1)14-15(17-12)11(7-8-16-14)13-6-3-9-18-13/h1-9,17H
InChIKeyVKEQYPHNKYFWFH-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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Related Compounds

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CID 64961
Harman
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Camalexin
CID 636970
3-Methyl-9h-pyrido[3,4-b]indole
CID 13315103
9H-Pyrido(3,4-b)indole, 1-methyl-, hydrochloride (1:1)
CID 5487918
Eudistomin U
CID 10334023
3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indole
CID 5329361
dimethyl(2-{3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indol-1-yl}ethyl)amine
CID 5329362
1-[2-(piperidin-1-yl)ethyl]-3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indole
CID 5329363
1-[3-(piperidin-1-yl)propyl]-3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indole
CID 5329365
1-[3-(4-methylpiperazin-1-yl)propyl]-3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indole
CID 5329366
dimethyl(3-{3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indol-1-yl}propyl)amine
CID 5329367

Frequently Asked Questions

What is the IUPAC name of 4-thiophen-2-yl-5H-pyrido[3,2-b]indole?
The IUPAC name of 4-thiophen-2-yl-5H-pyrido[3,2-b]indole (CID 10562637) is 4-thiophen-2-yl-5H-pyrido[3,2-b]indole.
What is the SMILES notation for 4-thiophen-2-yl-5H-pyrido[3,2-b]indole?
The canonical SMILES for 4-thiophen-2-yl-5H-pyrido[3,2-b]indole is c1csc(-c2ccnc3c2[nH]c2ccccc23)c1.
What is the InChIKey of 4-thiophen-2-yl-5H-pyrido[3,2-b]indole?
The InChIKey is VKEQYPHNKYFWFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2S/c1-2-5-12-10(4-1)14-15(17-12)11(7-8-16-14)13-6-3-9-18-13/h1-9,17H.
What are the key properties of 4-thiophen-2-yl-5H-pyrido[3,2-b]indole?
4-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 4-thiophen-2-yl-5H-pyrido[3,2-b]indole is sourced from PubChem (CID 10562637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).