2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide

C21H17FN4O3 — CID 86780898

IUPAC2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide
SMILESO=C(Cc1cccc(F)c1)NCC(=O)Nc1c(-c2ccco2)nc2ccccn12
InChIInChI=1S/C21H17FN4O3/c22-15-6-3-5-14(11-15)12-18(27)23-13-19(28)25-21-20(16-7-4-10-29-16)24-17-8-1-2-9-26(17)21/h1-11H,12-13H2,(H,23,27)(H,25,28)
InChIKeyACTDDPCCBNCPBN-UHFFFAOYSA-N
MW392.39 g/mol
LogP3.03
Rot. Bonds6

About 2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide

2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide (PubChem CID 86780898) has the molecular formula C21H17FN4O3 and a molecular weight of 392.39 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide
PubChem CID86780898
Molecular FormulaC21H17FN4O3
Molecular Weight392.39 g/mol
Exact Mass392.13
IUPAC Name2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide
SMILESO=C(Cc1cccc(F)c1)NCC(=O)Nc1c(-c2ccco2)nc2ccccn12
InChIInChI=1S/C21H17FN4O3/c22-15-6-3-5-14(11-15)12-18(27)23-13-19(28)25-21-20(16-7-4-10-29-16)24-17-8-1-2-9-26(17)21/h1-11H,12-13H2,(H,23,27)(H,25,28)
InChIKeyACTDDPCCBNCPBN-UHFFFAOYSA-N
XLogP3.03
TPSA88.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.39
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide (CID 86780898) is 2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide is O=C(Cc1cccc(F)c1)NCC(=O)Nc1c(-c2ccco2)nc2ccccn12.
What is the InChIKey of 2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide?
The InChIKey is ACTDDPCCBNCPBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17FN4O3/c22-15-6-3-5-14(11-15)12-18(27)23-13-19(28)25-21-20(16-7-4-10-29-16)24-17-8-1-2-9-26(17)21/h1-11H,12-13H2,(H,23,27)(H,25,28).
What are the key properties of 2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide?
2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide has a molecular weight of 392.39 g/mol, XLogP of 3.03, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-[2-[[2-(furan-2-yl)imidazo[1,2-a]pyridin-3-yl]amino]-2-oxoethyl]acetamide is sourced from PubChem (CID 86780898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).