2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine

C19H19ClFN3 — CID 45255360

IUPAC2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine
SMILESFc1c(Cl)cccc1-c1nc2ccccn2c1NC1CCCCC1
InChIInChI=1S/C19H19ClFN3/c20-15-10-6-9-14(17(15)21)18-19(22-13-7-2-1-3-8-13)24-12-5-4-11-16(24)23-18/h4-6,9-13,22H,1-3,7-8H2
InChIKeyDSKJRYQHWWQTLP-UHFFFAOYSA-N
MW343.83 g/mol
LogP5.54
Rot. Bonds3

About 2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine

2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine (PubChem CID 45255360) has the molecular formula C19H19ClFN3 and a molecular weight of 343.83 g/mol. Its IUPAC name is 2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine
PubChem CID45255360
Molecular FormulaC19H19ClFN3
Molecular Weight343.83 g/mol
Exact Mass343.13
IUPAC Name2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine
SMILESFc1c(Cl)cccc1-c1nc2ccccn2c1NC1CCCCC1
InChIInChI=1S/C19H19ClFN3/c20-15-10-6-9-14(17(15)21)18-19(22-13-7-2-1-3-8-13)24-12-5-4-11-16(24)23-18/h4-6,9-13,22H,1-3,7-8H2
InChIKeyDSKJRYQHWWQTLP-UHFFFAOYSA-N
XLogP5.54
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.83
LogP ≤ 55.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine (CID 45255360) is 2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine is Fc1c(Cl)cccc1-c1nc2ccccn2c1NC1CCCCC1.
What is the InChIKey of 2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is DSKJRYQHWWQTLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClFN3/c20-15-10-6-9-14(17(15)21)18-19(22-13-7-2-1-3-8-13)24-12-5-4-11-16(24)23-18/h4-6,9-13,22H,1-3,7-8H2.
What are the key properties of 2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine?
2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 343.83 g/mol, XLogP of 5.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-2-fluorophenyl)-N-cyclohexylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 45255360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).