4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine

C19H15N5OS — CID 66760735

IUPAC4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine
SMILESCc1ncc(-c2cnc(N)c3oc(-c4csc5cnccc45)cc23)n1C
InChIInChI=1S/C19H15N5OS/c1-10-22-7-15(24(10)2)13-6-23-19(20)18-12(13)5-16(25-18)14-9-26-17-8-21-4-3-11(14)17/h3-9H,1-2H3,(H2,20,23)
InChIKeyBVGRLMLORMNSAH-UHFFFAOYSA-N
MW361.43 g/mol
LogP4.40
Rot. Bonds2

About 4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine

4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine (PubChem CID 66760735) has the molecular formula C19H15N5OS and a molecular weight of 361.43 g/mol. Its IUPAC name is 4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine.

Molecular Properties

Compound Name4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine
PubChem CID66760735
Molecular FormulaC19H15N5OS
Molecular Weight361.43 g/mol
Exact Mass361.10
IUPAC Name4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine
SMILESCc1ncc(-c2cnc(N)c3oc(-c4csc5cnccc45)cc23)n1C
InChIInChI=1S/C19H15N5OS/c1-10-22-7-15(24(10)2)13-6-23-19(20)18-12(13)5-16(25-18)14-9-26-17-8-21-4-3-11(14)17/h3-9H,1-2H3,(H2,20,23)
InChIKeyBVGRLMLORMNSAH-UHFFFAOYSA-N
XLogP4.40
TPSA82.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.43
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine?
The IUPAC name of 4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine (CID 66760735) is 4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine.
What is the SMILES notation for 4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine?
The canonical SMILES for 4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine is Cc1ncc(-c2cnc(N)c3oc(-c4csc5cnccc45)cc23)n1C.
What is the InChIKey of 4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine?
The InChIKey is BVGRLMLORMNSAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5OS/c1-10-22-7-15(24(10)2)13-6-23-19(20)18-12(13)5-16(25-18)14-9-26-17-8-21-4-3-11(14)17/h3-9H,1-2H3,(H2,20,23).
What are the key properties of 4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine?
4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine has a molecular weight of 361.43 g/mol, XLogP of 4.40, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dimethylimidazol-4-yl)-2-thieno[2,3-c]pyridin-3-ylfuro[2,3-c]pyridin-7-amine is sourced from PubChem (CID 66760735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).