4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide

C18H11FN6O — CID 139509392

IUPAC4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
SMILESN#Cc1cnc2ccc(-c3c(-c4ccc(F)cc4)n[nH]c3C(N)=O)cn12
InChIInChI=1S/C18H11FN6O/c19-12-4-1-10(2-5-12)16-15(17(18(21)26)24-23-16)11-3-6-14-22-8-13(7-20)25(14)9-11/h1-6,8-9H,(H2,21,26)(H,23,24)
InChIKeyPLBDZJKFFHEJID-UHFFFAOYSA-N
MW346.33 g/mol
LogP2.50
Rot. Bonds3

About 4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide

4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide (PubChem CID 139509392) has the molecular formula C18H11FN6O and a molecular weight of 346.33 g/mol. Its IUPAC name is 4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
PubChem CID139509392
Molecular FormulaC18H11FN6O
Molecular Weight346.33 g/mol
Exact Mass346.10
IUPAC Name4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide
SMILESN#Cc1cnc2ccc(-c3c(-c4ccc(F)cc4)n[nH]c3C(N)=O)cn12
InChIInChI=1S/C18H11FN6O/c19-12-4-1-10(2-5-12)16-15(17(18(21)26)24-23-16)11-3-6-14-22-8-13(7-20)25(14)9-11/h1-6,8-9H,(H2,21,26)(H,23,24)
InChIKeyPLBDZJKFFHEJID-UHFFFAOYSA-N
XLogP2.50
TPSA112.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.33
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide (CID 139509392) is 4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide is N#Cc1cnc2ccc(-c3c(-c4ccc(F)cc4)n[nH]c3C(N)=O)cn12.
What is the InChIKey of 4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide?
The InChIKey is PLBDZJKFFHEJID-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11FN6O/c19-12-4-1-10(2-5-12)16-15(17(18(21)26)24-23-16)11-3-6-14-22-8-13(7-20)25(14)9-11/h1-6,8-9H,(H2,21,26)(H,23,24).
What are the key properties of 4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide?
4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide has a molecular weight of 346.33 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyanoimidazo[1,2-a]pyridin-6-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 139509392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).