2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile

C15H9ClFN3 — CID 82223727

IUPAC2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile
SMILESN#Cc1c(Cc2ccc(Cl)cc2)nc2ccc(F)cn12
InChIInChI=1S/C15H9ClFN3/c16-11-3-1-10(2-4-11)7-13-14(8-18)20-9-12(17)5-6-15(20)19-13/h1-6,9H,7H2
InChIKeyXBSZOBGTMQVMSX-UHFFFAOYSA-N
MW285.71 g/mol
LogP3.59
Rot. Bonds2

About 2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile

2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile (PubChem CID 82223727) has the molecular formula C15H9ClFN3 and a molecular weight of 285.71 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile
PubChem CID82223727
Molecular FormulaC15H9ClFN3
Molecular Weight285.71 g/mol
Exact Mass285.05
IUPAC Name2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile
SMILESN#Cc1c(Cc2ccc(Cl)cc2)nc2ccc(F)cn12
InChIInChI=1S/C15H9ClFN3/c16-11-3-1-10(2-4-11)7-13-14(8-18)20-9-12(17)5-6-15(20)19-13/h1-6,9H,7H2
InChIKeyXBSZOBGTMQVMSX-UHFFFAOYSA-N
XLogP3.59
TPSA41.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.71
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-benzyl-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile
CID 82223118
2-[(4-fluorophenyl)methyl]-6-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carbonitrile
CID 94964291
2-[(4-methoxyphenyl)methyl]-6-methylimidazo[1,2-a]pyridine-3-carbonitrile
CID 82223229
6-fluoro-2-propan-2-ylimidazo[1,2-a]pyridine-3-carbonitrile
CID 82060672
7-chloro-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbonitrile
CID 82529903
2-benzyl-6-fluoroimidazo[1,2-a]pyridine-3-carbothioamide
CID 82530283
1-(2-benzyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)ethanol
CID 82530281
(2-benzyl-6-fluoroimidazo[1,2-a]pyridin-3-yl)methanamine
CID 82223117
2-(4-chlorophenyl)-6-fluoroimidazo[1,2-a]pyridin-3-amine
CID 63616952
6-chloro-3-(chloromethyl)-2-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridine
CID 94963899
[6-chloro-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridin-3-yl]methanol
CID 82223169
6-chloro-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridine-3-carbaldehyde
CID 82530278

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile?
The IUPAC name of 2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile (CID 82223727) is 2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile.
What is the SMILES notation for 2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile?
The canonical SMILES for 2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile is N#Cc1c(Cc2ccc(Cl)cc2)nc2ccc(F)cn12.
What is the InChIKey of 2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile?
The InChIKey is XBSZOBGTMQVMSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClFN3/c16-11-3-1-10(2-4-11)7-13-14(8-18)20-9-12(17)5-6-15(20)19-13/h1-6,9H,7H2.
What are the key properties of 2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile?
2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile has a molecular weight of 285.71 g/mol, XLogP of 3.59, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)methyl]-6-fluoroimidazo[1,2-a]pyridine-3-carbonitrile is sourced from PubChem (CID 82223727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).