[3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane

C17H18F2N2O — CID 177220962

IUPAC[3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane
SMILESCC.OCc1ccn2c(Cc3ccc(F)c(F)c3)cnc2c1
InChIInChI=1S/C15H12F2N2O.C2H6/c16-13-2-1-10(6-14(13)17)5-12-8-18-15-7-11(9-20)3-4-19(12)15;1-2/h1-4,6-8,20H,5,9H2;1-2H3
InChIKeyNOODLOCAUXJMRF-UHFFFAOYSA-N
MW304.34 g/mol
LogP3.72
Rot. Bonds3

About [3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane

[3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane (PubChem CID 177220962) has the molecular formula C17H18F2N2O and a molecular weight of 304.34 g/mol. Its IUPAC name is [3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane.

Molecular Properties

Compound Name[3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane
PubChem CID177220962
Molecular FormulaC17H18F2N2O
Molecular Weight304.34 g/mol
Exact Mass304.14
IUPAC Name[3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane
SMILESCC.OCc1ccn2c(Cc3ccc(F)c(F)c3)cnc2c1
InChIInChI=1S/C15H12F2N2O.C2H6/c16-13-2-1-10(6-14(13)17)5-12-8-18-15-7-11(9-20)3-4-19(12)15;1-2/h1-4,6-8,20H,5,9H2;1-2H3
InChIKeyNOODLOCAUXJMRF-UHFFFAOYSA-N
XLogP3.72
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.34
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane?
The IUPAC name of [3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane (CID 177220962) is [3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane.
What is the SMILES notation for [3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane?
The canonical SMILES for [3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane is CC.OCc1ccn2c(Cc3ccc(F)c(F)c3)cnc2c1.
What is the InChIKey of [3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane?
The InChIKey is NOODLOCAUXJMRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F2N2O.C2H6/c16-13-2-1-10(6-14(13)17)5-12-8-18-15-7-11(9-20)3-4-19(12)15;1-2/h1-4,6-8,20H,5,9H2;1-2H3.
What are the key properties of [3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane?
[3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane has a molecular weight of 304.34 g/mol, XLogP of 3.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(3,4-difluorophenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methanol;ethane is sourced from PubChem (CID 177220962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).