5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine

C24H21N7OS — CID 126612475

IUPAC5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine
SMILESCc1c(-c2cc3c(C)c(-c4cc5c(C)coc5c(N)n4)sc3c(N)n2)[nH]c2c(N)nccc12
InChIInChI=1S/C24H21N7OS/c1-9-8-32-19-13(9)6-16(30-23(19)26)20-11(3)14-7-15(29-24(27)21(14)33-20)17-10(2)12-4-5-28-22(25)18(12)31-17/h4-8,31H,1-3H3,(H2,25,28)(H2,26,30)(H2,27,29)
InChIKeyYSOWREIVRFIRBN-UHFFFAOYSA-N
MW455.55 g/mol
LogP5.32
Rot. Bonds2

About 5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine

5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine (PubChem CID 126612475) has the molecular formula C24H21N7OS and a molecular weight of 455.55 g/mol. Its IUPAC name is 5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine.

Molecular Properties

Compound Name5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine
PubChem CID126612475
Molecular FormulaC24H21N7OS
Molecular Weight455.55 g/mol
Exact Mass455.15
IUPAC Name5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine
SMILESCc1c(-c2cc3c(C)c(-c4cc5c(C)coc5c(N)n4)sc3c(N)n2)[nH]c2c(N)nccc12
InChIInChI=1S/C24H21N7OS/c1-9-8-32-19-13(9)6-16(30-23(19)26)20-11(3)14-7-15(29-24(27)21(14)33-20)17-10(2)12-4-5-28-22(25)18(12)31-17/h4-8,31H,1-3H3,(H2,25,28)(H2,26,30)(H2,27,29)
InChIKeyYSOWREIVRFIRBN-UHFFFAOYSA-N
XLogP5.32
TPSA145.66 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500455.55
LogP ≤ 55.32
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Analyze 5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine?
The IUPAC name of 5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine (CID 126612475) is 5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine.
What is the SMILES notation for 5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine?
The canonical SMILES for 5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine is Cc1c(-c2cc3c(C)c(-c4cc5c(C)coc5c(N)n4)sc3c(N)n2)[nH]c2c(N)nccc12.
What is the InChIKey of 5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine?
The InChIKey is YSOWREIVRFIRBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N7OS/c1-9-8-32-19-13(9)6-16(30-23(19)26)20-11(3)14-7-15(29-24(27)21(14)33-20)17-10(2)12-4-5-28-22(25)18(12)31-17/h4-8,31H,1-3H3,(H2,25,28)(H2,26,30)(H2,27,29).
What are the key properties of 5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine?
5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine has a molecular weight of 455.55 g/mol, XLogP of 5.32, 2 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[7-amino-5-(7-amino-3-methyl-1H-pyrrolo[2,3-c]pyridin-2-yl)-3-methylthieno[2,3-c]pyridin-2-yl]-3-methylfuro[2,3-c]pyridin-7-amine is sourced from PubChem (CID 126612475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).