2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine

C20H17N5OS — CID 66759463

IUPAC2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine
SMILESCc1nn(C)c(C)c1-c1cnc(N)c2oc(-c3csc4cnccc34)cc12
InChIInChI=1S/C20H17N5OS/c1-10-18(11(2)25(3)24-10)14-7-23-20(21)19-13(14)6-16(26-19)15-9-27-17-8-22-5-4-12(15)17/h4-9H,1-3H3,(H2,21,23)
InChIKeyKQRHOCBFNKSFDP-UHFFFAOYSA-N
MW375.46 g/mol
LogP4.70
Rot. Bonds2

About 2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine

2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine (PubChem CID 66759463) has the molecular formula C20H17N5OS and a molecular weight of 375.46 g/mol. Its IUPAC name is 2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine.

Molecular Properties

Compound Name2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine
PubChem CID66759463
Molecular FormulaC20H17N5OS
Molecular Weight375.46 g/mol
Exact Mass375.12
IUPAC Name2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine
SMILESCc1nn(C)c(C)c1-c1cnc(N)c2oc(-c3csc4cnccc34)cc12
InChIInChI=1S/C20H17N5OS/c1-10-18(11(2)25(3)24-10)14-7-23-20(21)19-13(14)6-16(26-19)15-9-27-17-8-22-5-4-12(15)17/h4-9H,1-3H3,(H2,21,23)
InChIKeyKQRHOCBFNKSFDP-UHFFFAOYSA-N
XLogP4.70
TPSA82.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.46
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine?
The IUPAC name of 2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine (CID 66759463) is 2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine.
What is the SMILES notation for 2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine?
The canonical SMILES for 2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine is Cc1nn(C)c(C)c1-c1cnc(N)c2oc(-c3csc4cnccc34)cc12.
What is the InChIKey of 2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine?
The InChIKey is KQRHOCBFNKSFDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5OS/c1-10-18(11(2)25(3)24-10)14-7-23-20(21)19-13(14)6-16(26-19)15-9-27-17-8-22-5-4-12(15)17/h4-9H,1-3H3,(H2,21,23).
What are the key properties of 2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine?
2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine has a molecular weight of 375.46 g/mol, XLogP of 4.70, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thieno[2,3-c]pyridin-3-yl-4-(1,3,5-trimethylpyrazol-4-yl)furo[2,3-c]pyridin-7-amine is sourced from PubChem (CID 66759463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).