4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine

C26H21FN4S — CID 130283088

IUPAC4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine
SMILESCc1ccc2nc(/C=C/c3ccccc3)c(N(C)c3nc(-c4ccc(F)cc4)cs3)n2c1
InChIInChI=1S/C26H21FN4S/c1-18-8-15-24-28-22(14-9-19-6-4-3-5-7-19)25(31(24)16-18)30(2)26-29-23(17-32-26)20-10-12-21(27)13-11-20/h3-17H,1-2H3/b14-9+
InChIKeyPDNPPEJHAFWLAL-NTEUORMPSA-N
MW440.55 g/mol
LogP6.84
Rot. Bonds5

About 4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine

4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine (PubChem CID 130283088) has the molecular formula C26H21FN4S and a molecular weight of 440.55 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine
PubChem CID130283088
Molecular FormulaC26H21FN4S
Molecular Weight440.55 g/mol
Exact Mass440.15
IUPAC Name4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine
SMILESCc1ccc2nc(/C=C/c3ccccc3)c(N(C)c3nc(-c4ccc(F)cc4)cs3)n2c1
InChIInChI=1S/C26H21FN4S/c1-18-8-15-24-28-22(14-9-19-6-4-3-5-7-19)25(31(24)16-18)30(2)26-29-23(17-32-26)20-10-12-21(27)13-11-20/h3-17H,1-2H3/b14-9+
InChIKeyPDNPPEJHAFWLAL-NTEUORMPSA-N
XLogP6.84
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.55
LogP ≤ 56.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine with MolForge

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Related Compounds

N-[6-bromo-2-(2-phenylethenyl)imidazo[1,2-a]pyridin-3-yl]-4-(4-fluorophenyl)-N-methyl-1,3-thiazol-2-amine
CID 123169998
N-[6-bromo-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-4-(4-fluorophenyl)-N-methyl-1,3-thiazol-2-amine
CID 90420599
N-(2-ethyl-6-iodoimidazo[1,2-a]pyridin-3-yl)-4-(4-fluorophenyl)-N-methyl-1,3-thiazol-2-amine
CID 90446713
N-(2-ethyl-6,8-dimethylimidazo[1,2-a]pyridin-3-yl)-4-(4-fluorophenyl)-N-methyl-1,3-thiazol-2-amine
CID 155469556
N-(2-ethyl-6-pentan-2-ylimidazo[1,2-a]pyridin-3-yl)-4-(4-fluorophenyl)-N-methyl-1,3-thiazol-2-amine
CID 123821766
4-[2-ethyl-3-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]imidazo[1,2-a]pyridin-6-yl]piperazine-1-carboxylic acid
CID 130273086
1-[4-[2-ethyl-3-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]imidazo[1,2-a]pyridin-6-yl]piperazin-1-yl]propan-1-one
CID 78425994
ethyl 2-[4-[2-ethyl-3-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]imidazo[1,2-a]pyridin-6-yl]-3,6-dihydro-2H-pyridin-1-yl]acetate
CID 90446855
N-[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-ethylimidazo[1,2-a]pyridin-3-yl]-4-(4-fluorophenyl)-N-methyl-1,3-thiazol-2-amine
CID 90446897
2-(dimethylamino)-1-[4-[2-ethyl-3-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]imidazo[1,2-a]pyridin-6-yl]piperidin-1-yl]ethanone
CID 90421240
2-[4-[2-ethyl-3-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]imidazo[1,2-a]pyridin-6-yl]piperidin-1-yl]acetic acid
CID 130274172
3-[3-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-6-(1-methylsulfanylpiperidin-4-yl)imidazo[1,2-a]pyridin-2-yl]propanenitrile
CID 130283809

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine?
The IUPAC name of 4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine (CID 130283088) is 4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine is Cc1ccc2nc(/C=C/c3ccccc3)c(N(C)c3nc(-c4ccc(F)cc4)cs3)n2c1.
What is the InChIKey of 4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine?
The InChIKey is PDNPPEJHAFWLAL-NTEUORMPSA-N. The full InChI is InChI=1S/C26H21FN4S/c1-18-8-15-24-28-22(14-9-19-6-4-3-5-7-19)25(31(24)16-18)30(2)26-29-23(17-32-26)20-10-12-21(27)13-11-20/h3-17H,1-2H3/b14-9+.
What are the key properties of 4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine?
4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine has a molecular weight of 440.55 g/mol, XLogP of 6.84, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-N-methyl-N-[6-methyl-2-[(E)-2-phenylethenyl]imidazo[1,2-a]pyridin-3-yl]-1,3-thiazol-2-amine is sourced from PubChem (CID 130283088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).