N-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide

C23H23N7O — CID 67260647

IUPACN-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nn(Cc2ccnn2CC)c2cccc(NC(=O)c3cnc4ccccn34)c12
InChIInChI=1S/C23H23N7O/c1-3-17-22-18(26-23(31)20-14-24-21-10-5-6-13-28(20)21)8-7-9-19(22)30(27-17)15-16-11-12-25-29(16)4-2/h5-14H,3-4,15H2,1-2H3,(H,26,31)
InChIKeyYZQBDBRJSKLRTN-UHFFFAOYSA-N
MW413.49 g/mol
LogP3.76
Rot. Bonds6

About N-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide

N-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 67260647) has the molecular formula C23H23N7O and a molecular weight of 413.49 g/mol. Its IUPAC name is N-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID67260647
Molecular FormulaC23H23N7O
Molecular Weight413.49 g/mol
Exact Mass413.20
IUPAC NameN-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCc1nn(Cc2ccnn2CC)c2cccc(NC(=O)c3cnc4ccccn34)c12
InChIInChI=1S/C23H23N7O/c1-3-17-22-18(26-23(31)20-14-24-21-10-5-6-13-28(20)21)8-7-9-19(22)30(27-17)15-16-11-12-25-29(16)4-2/h5-14H,3-4,15H2,1-2H3,(H,26,31)
InChIKeyYZQBDBRJSKLRTN-UHFFFAOYSA-N
XLogP3.76
TPSA82.04 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.49
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide (CID 67260647) is N-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide is CCc1nn(Cc2ccnn2CC)c2cccc(NC(=O)c3cnc4ccccn34)c12.
What is the InChIKey of N-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is YZQBDBRJSKLRTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N7O/c1-3-17-22-18(26-23(31)20-14-24-21-10-5-6-13-28(20)21)8-7-9-19(22)30(27-17)15-16-11-12-25-29(16)4-2/h5-14H,3-4,15H2,1-2H3,(H,26,31).
What are the key properties of N-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide?
N-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 413.49 g/mol, XLogP of 3.76, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-ethyl-1-[(2-ethylpyrazol-3-yl)methyl]indazol-4-yl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 67260647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).