[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid

C20H14FN3O2 — CID 91112338

IUPAC[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid
SMILESO=C(O)Nc1cccc(-c2cnc3cc(-c4ccc(F)cc4)ccn23)c1
InChIInChI=1S/C20H14FN3O2/c21-16-6-4-13(5-7-16)14-8-9-24-18(12-22-19(24)11-14)15-2-1-3-17(10-15)23-20(25)26/h1-12,23H,(H,25,26)
InChIKeyWCMWHZDDXPOUBU-UHFFFAOYSA-N
MW347.35 g/mol
LogP4.90
Rot. Bonds3

About [3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid

[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid (PubChem CID 91112338) has the molecular formula C20H14FN3O2 and a molecular weight of 347.35 g/mol. Its IUPAC name is [3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid.

Molecular Properties

Compound Name[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid
PubChem CID91112338
Molecular FormulaC20H14FN3O2
Molecular Weight347.35 g/mol
Exact Mass347.11
IUPAC Name[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid
SMILESO=C(O)Nc1cccc(-c2cnc3cc(-c4ccc(F)cc4)ccn23)c1
InChIInChI=1S/C20H14FN3O2/c21-16-6-4-13(5-7-16)14-8-9-24-18(12-22-19(24)11-14)15-2-1-3-17(10-15)23-20(25)26/h1-12,23H,(H,25,26)
InChIKeyWCMWHZDDXPOUBU-UHFFFAOYSA-N
XLogP4.90
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.35
LogP ≤ 54.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]aniline;3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]aniline
CID 161390343
3-[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]sulfonyl-1,1-dimethylurea
CID 68595157
N-[3-[7-[3-(cyanomethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]phenyl]acetamide
CID 59321077
1-ethyl-3-[3-[7-(4-piperazin-1-ylphenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]urea;molecular hydrogen
CID 143706851
3-[3-[3-(2,2,2-trifluoroethylcarbamoylamino)phenyl]imidazo[1,2-a]pyridin-7-yl]benzamide
CID 59320936
N-(3-acetylphenyl)-2-[2-fluoro-4-(7-pyridin-4-ylimidazo[1,2-a]pyridin-3-yl)phenyl]acetamide
CID 68621927
methyl 2-[4-[3-[3-[2-(4-fluorophenyl)ethyl]phenyl]imidazo[1,2-a]pyridin-7-yl]phenyl]-2-methylpropanoate
CID 143707078
1-ethyl-3-[3-(7-methylimidazo[1,2-a]pyridin-3-yl)phenyl]urea
CID 59320921
1-[3-[7-(2H-triazol-4-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]-3-(2,2,2-trifluoroethyl)urea
CID 59320990
[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-pyridin-4-ylanilino] formate
CID 87543655
1-[2-fluoro-5-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]-3-(2,2,2-trifluoroethyl)urea
CID 59321126
3-[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]-1,2,4-thiadiazol-5-amine
CID 118431180

Frequently Asked Questions

What is the IUPAC name of [3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid?
The IUPAC name of [3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid (CID 91112338) is [3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid.
What is the SMILES notation for [3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid?
The canonical SMILES for [3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid is O=C(O)Nc1cccc(-c2cnc3cc(-c4ccc(F)cc4)ccn23)c1.
What is the InChIKey of [3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid?
The InChIKey is WCMWHZDDXPOUBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14FN3O2/c21-16-6-4-13(5-7-16)14-8-9-24-18(12-22-19(24)11-14)15-2-1-3-17(10-15)23-20(25)26/h1-12,23H,(H,25,26).
What are the key properties of [3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid?
[3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid has a molecular weight of 347.35 g/mol, XLogP of 4.90, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[7-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]carbamic acid is sourced from PubChem (CID 91112338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).