4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine

C20H13N7O — CID 136936915

IUPAC4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine
SMILESc1cc2[nH]c(-c3n[nH]c4ccc(-c5cn[nH]c5)cc34)nc2c(-c2ccoc2)n1
InChIInChI=1S/C20H13N7O/c1-2-15-14(7-11(1)13-8-22-23-9-13)18(27-26-15)20-24-16-3-5-21-17(19(16)25-20)12-4-6-28-10-12/h1-10H,(H,22,23)(H,24,25)(H,26,27)
InChIKeyXCRMAZXGEZLMDW-UHFFFAOYSA-N
MW367.37 g/mol
LogP4.15
Rot. Bonds3

About 4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine

4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine (PubChem CID 136936915) has the molecular formula C20H13N7O and a molecular weight of 367.37 g/mol. Its IUPAC name is 4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine
PubChem CID136936915
Molecular FormulaC20H13N7O
Molecular Weight367.37 g/mol
Exact Mass367.12
IUPAC Name4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine
SMILESc1cc2[nH]c(-c3n[nH]c4ccc(-c5cn[nH]c5)cc34)nc2c(-c2ccoc2)n1
InChIInChI=1S/C20H13N7O/c1-2-15-14(7-11(1)13-8-22-23-9-13)18(27-26-15)20-24-16-3-5-21-17(19(16)25-20)12-4-6-28-10-12/h1-10H,(H,22,23)(H,24,25)(H,26,27)
InChIKeyXCRMAZXGEZLMDW-UHFFFAOYSA-N
XLogP4.15
TPSA112.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.37
LogP ≤ 54.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine?
The IUPAC name of 4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine (CID 136936915) is 4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine?
The canonical SMILES for 4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine is c1cc2[nH]c(-c3n[nH]c4ccc(-c5cn[nH]c5)cc34)nc2c(-c2ccoc2)n1.
What is the InChIKey of 4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine?
The InChIKey is XCRMAZXGEZLMDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13N7O/c1-2-15-14(7-11(1)13-8-22-23-9-13)18(27-26-15)20-24-16-3-5-21-17(19(16)25-20)12-4-6-28-10-12/h1-10H,(H,22,23)(H,24,25)(H,26,27).
What are the key properties of 4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine?
4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine has a molecular weight of 367.37 g/mol, XLogP of 4.15, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-3-yl)-2-[5-(1H-pyrazol-4-yl)-1H-indazol-3-yl]-1H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 136936915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).