1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide

C24H18FN5O2 — CID 97362166

IUPAC1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide
SMILESCOc1ncccc1NC(=O)c1ccn(-c2ccc3ccc(-c4ccc(F)cc4)cn23)n1
InChIInChI=1S/C24H18FN5O2/c1-32-24-21(3-2-13-26-24)27-23(31)20-12-14-30(28-20)22-11-10-19-9-6-17(15-29(19)22)16-4-7-18(25)8-5-16/h2-15H,1H3,(H,27,31)
InChIKeyMVISFKSUNIVGFH-UHFFFAOYSA-N
MW427.44 g/mol
LogP4.59
Rot. Bonds5

About 1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide

1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide (PubChem CID 97362166) has the molecular formula C24H18FN5O2 and a molecular weight of 427.44 g/mol. Its IUPAC name is 1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide
PubChem CID97362166
Molecular FormulaC24H18FN5O2
Molecular Weight427.44 g/mol
Exact Mass427.14
IUPAC Name1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide
SMILESCOc1ncccc1NC(=O)c1ccn(-c2ccc3ccc(-c4ccc(F)cc4)cn23)n1
InChIInChI=1S/C24H18FN5O2/c1-32-24-21(3-2-13-26-24)27-23(31)20-12-14-30(28-20)22-11-10-19-9-6-17(15-29(19)22)16-4-7-18(25)8-5-16/h2-15H,1H3,(H,27,31)
InChIKeyMVISFKSUNIVGFH-UHFFFAOYSA-N
XLogP4.59
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500427.44
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide?
The IUPAC name of 1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide (CID 97362166) is 1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide.
What is the SMILES notation for 1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide?
The canonical SMILES for 1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide is COc1ncccc1NC(=O)c1ccn(-c2ccc3ccc(-c4ccc(F)cc4)cn23)n1.
What is the InChIKey of 1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide?
The InChIKey is MVISFKSUNIVGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18FN5O2/c1-32-24-21(3-2-13-26-24)27-23(31)20-12-14-30(28-20)22-11-10-19-9-6-17(15-29(19)22)16-4-7-18(25)8-5-16/h2-15H,1H3,(H,27,31).
What are the key properties of 1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide?
1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide has a molecular weight of 427.44 g/mol, XLogP of 4.59, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(4-fluorophenyl)indolizin-3-yl]-N-(2-methoxy-3-pyridinyl)pyrazole-3-carboxamide is sourced from PubChem (CID 97362166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).