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

C20H15N3OS2 — CID 123272978

IUPACN-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine
SMILESCc1cc(-c2cncc3scc(Nc4nccc5ccoc45)c23)c(C)s1
InChIInChI=1S/C20H15N3OS2/c1-11-7-14(12(2)26-11)15-8-21-9-17-18(15)16(10-25-17)23-20-19-13(3-5-22-20)4-6-24-19/h3-10H,1-2H3,(H,22,23)
InChIKeyHTBRJLWIYYZNQE-UHFFFAOYSA-N
MW377.49 g/mol
LogP6.53
Rot. Bonds3

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

N-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine (PubChem CID 123272978) has the molecular formula C20H15N3OS2 and a molecular weight of 377.49 g/mol. Its IUPAC name is N-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine.

Molecular Properties

Compound NameN-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine
PubChem CID123272978
Molecular FormulaC20H15N3OS2
Molecular Weight377.49 g/mol
Exact Mass377.07
IUPAC NameN-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine
SMILESCc1cc(-c2cncc3scc(Nc4nccc5ccoc45)c23)c(C)s1
InChIInChI=1S/C20H15N3OS2/c1-11-7-14(12(2)26-11)15-8-21-9-17-18(15)16(10-25-17)23-20-19-13(3-5-22-20)4-6-24-19/h3-10H,1-2H3,(H,22,23)
InChIKeyHTBRJLWIYYZNQE-UHFFFAOYSA-N
XLogP6.53
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.49
LogP ≤ 56.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[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 N-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine?
The IUPAC name of N-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine (CID 123272978) is N-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine.
What is the SMILES notation for N-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine?
The canonical SMILES for N-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine is Cc1cc(-c2cncc3scc(Nc4nccc5ccoc45)c23)c(C)s1.
What is the InChIKey of N-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine?
The InChIKey is HTBRJLWIYYZNQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3OS2/c1-11-7-14(12(2)26-11)15-8-21-9-17-18(15)16(10-25-17)23-20-19-13(3-5-22-20)4-6-24-19/h3-10H,1-2H3,(H,22,23).
What are the key properties of N-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine?
N-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine has a molecular weight of 377.49 g/mol, XLogP of 6.53, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,5-dimethylthiophen-3-yl)thieno[2,3-c]pyridin-3-yl]furo[2,3-c]pyridin-7-amine is sourced from PubChem (CID 123272978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).