[8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol

C20H19FN4OS — CID 58207942

IUPAC[8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol
SMILESCC(C)Nc1ncc(-c2cc(-c3ccccc3F)c3nc(CO)cn3c2)s1
InChIInChI=1S/C20H19FN4OS/c1-12(2)23-20-22-8-18(27-20)13-7-16(15-5-3-4-6-17(15)21)19-24-14(11-26)10-25(19)9-13/h3-10,12,26H,11H2,1-2H3,(H,22,23)
InChIKeyUPZWZPNNZOKNGD-UHFFFAOYSA-N
MW382.46 g/mol
LogP4.58
Rot. Bonds5

About [8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol

[8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol (PubChem CID 58207942) has the molecular formula C20H19FN4OS and a molecular weight of 382.46 g/mol. Its IUPAC name is [8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol.

Molecular Properties

Compound Name[8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol
PubChem CID58207942
Molecular FormulaC20H19FN4OS
Molecular Weight382.46 g/mol
Exact Mass382.13
IUPAC Name[8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol
SMILESCC(C)Nc1ncc(-c2cc(-c3ccccc3F)c3nc(CO)cn3c2)s1
InChIInChI=1S/C20H19FN4OS/c1-12(2)23-20-22-8-18(27-20)13-7-16(15-5-3-4-6-17(15)21)19-24-14(11-26)10-25(19)9-13/h3-10,12,26H,11H2,1-2H3,(H,22,23)
InChIKeyUPZWZPNNZOKNGD-UHFFFAOYSA-N
XLogP4.58
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol?
The IUPAC name of [8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol (CID 58207942) is [8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol.
What is the SMILES notation for [8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol?
The canonical SMILES for [8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol is CC(C)Nc1ncc(-c2cc(-c3ccccc3F)c3nc(CO)cn3c2)s1.
What is the InChIKey of [8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol?
The InChIKey is UPZWZPNNZOKNGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN4OS/c1-12(2)23-20-22-8-18(27-20)13-7-16(15-5-3-4-6-17(15)21)19-24-14(11-26)10-25(19)9-13/h3-10,12,26H,11H2,1-2H3,(H,22,23).
What are the key properties of [8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol?
[8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol has a molecular weight of 382.46 g/mol, XLogP of 4.58, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [8-(2-fluorophenyl)-6-[2-(propan-2-ylamino)-1,3-thiazol-5-yl]imidazo[1,2-a]pyridin-2-yl]methanol is sourced from PubChem (CID 58207942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).