2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde

C16H11FN4O — CID 162759387

IUPAC2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde
SMILESNc1nc2ccc(-c3cc(F)cc4[nH]ccc34)cn2c1C=O
InChIInChI=1S/C16H11FN4O/c17-10-5-12(11-3-4-19-13(11)6-10)9-1-2-15-20-16(18)14(8-22)21(15)7-9/h1-8,19H,18H2
InChIKeyCGVJQPJQIVMTED-UHFFFAOYSA-N
MW294.29 g/mol
LogP3.02
Rot. Bonds2

About 2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde

2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde (PubChem CID 162759387) has the molecular formula C16H11FN4O and a molecular weight of 294.29 g/mol. Its IUPAC name is 2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde.

Molecular Properties

Compound Name2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde
PubChem CID162759387
Molecular FormulaC16H11FN4O
Molecular Weight294.29 g/mol
Exact Mass294.09
IUPAC Name2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde
SMILESNc1nc2ccc(-c3cc(F)cc4[nH]ccc34)cn2c1C=O
InChIInChI=1S/C16H11FN4O/c17-10-5-12(11-3-4-19-13(11)6-10)9-1-2-15-20-16(18)14(8-22)21(15)7-9/h1-8,19H,18H2
InChIKeyCGVJQPJQIVMTED-UHFFFAOYSA-N
XLogP3.02
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.29
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde?
The IUPAC name of 2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde (CID 162759387) is 2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde.
What is the SMILES notation for 2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde?
The canonical SMILES for 2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde is Nc1nc2ccc(-c3cc(F)cc4[nH]ccc34)cn2c1C=O.
What is the InChIKey of 2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde?
The InChIKey is CGVJQPJQIVMTED-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN4O/c17-10-5-12(11-3-4-19-13(11)6-10)9-1-2-15-20-16(18)14(8-22)21(15)7-9/h1-8,19H,18H2.
What are the key properties of 2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde?
2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde has a molecular weight of 294.29 g/mol, XLogP of 3.02, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(6-fluoro-1H-indol-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde is sourced from PubChem (CID 162759387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).