N-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide

C21H17N7O — CID 155167366

IUPACN-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide
SMILESO=C(NCc1cn2cc(Nc3cccnc3)ccc2n1)c1cccc2[nH]ncc12
InChIInChI=1S/C21H17N7O/c29-21(17-4-1-5-19-18(17)11-24-27-19)23-10-16-13-28-12-15(6-7-20(28)26-16)25-14-3-2-8-22-9-14/h1-9,11-13,25H,10H2,(H,23,29)(H,24,27)
InChIKeyYTDHTLYFOUJMIK-UHFFFAOYSA-N
MW383.42 g/mol
LogP3.28
Rot. Bonds5

About N-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide

N-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide (PubChem CID 155167366) has the molecular formula C21H17N7O and a molecular weight of 383.42 g/mol. Its IUPAC name is N-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide.

Molecular Properties

Compound NameN-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide
PubChem CID155167366
Molecular FormulaC21H17N7O
Molecular Weight383.42 g/mol
Exact Mass383.15
IUPAC NameN-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide
SMILESO=C(NCc1cn2cc(Nc3cccnc3)ccc2n1)c1cccc2[nH]ncc12
InChIInChI=1S/C21H17N7O/c29-21(17-4-1-5-19-18(17)11-24-27-19)23-10-16-13-28-12-15(6-7-20(28)26-16)25-14-3-2-8-22-9-14/h1-9,11-13,25H,10H2,(H,23,29)(H,24,27)
InChIKeyYTDHTLYFOUJMIK-UHFFFAOYSA-N
XLogP3.28
TPSA100.00 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.42
LogP ≤ 53.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide?
The IUPAC name of N-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide (CID 155167366) is N-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide.
What is the SMILES notation for N-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide?
The canonical SMILES for N-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide is O=C(NCc1cn2cc(Nc3cccnc3)ccc2n1)c1cccc2[nH]ncc12.
What is the InChIKey of N-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide?
The InChIKey is YTDHTLYFOUJMIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N7O/c29-21(17-4-1-5-19-18(17)11-24-27-19)23-10-16-13-28-12-15(6-7-20(28)26-16)25-14-3-2-8-22-9-14/h1-9,11-13,25H,10H2,(H,23,29)(H,24,27).
What are the key properties of N-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide?
N-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide has a molecular weight of 383.42 g/mol, XLogP of 3.28, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(pyridin-3-ylamino)imidazo[1,2-a]pyridin-2-yl]methyl]-1H-indazole-4-carboxamide is sourced from PubChem (CID 155167366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).