3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide

C18H14FN5O — CID 90719550

IUPAC3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(Nc1ccncn1)C1=C2C=CC=CN2C(c2ccccc2F)N1
InChIInChI=1S/C18H14FN5O/c19-13-6-2-1-5-12(13)17-23-16(14-7-3-4-10-24(14)17)18(25)22-15-8-9-20-11-21-15/h1-11,17,23H,(H,20,21,22,25)
InChIKeyZAALIOOWXOEARV-UHFFFAOYSA-N
MW335.34 g/mol
LogP2.45
Rot. Bonds3

About 3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide

3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 90719550) has the molecular formula C18H14FN5O and a molecular weight of 335.34 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound Name3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID90719550
Molecular FormulaC18H14FN5O
Molecular Weight335.34 g/mol
Exact Mass335.12
IUPAC Name3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide
SMILESO=C(Nc1ccncn1)C1=C2C=CC=CN2C(c2ccccc2F)N1
InChIInChI=1S/C18H14FN5O/c19-13-6-2-1-5-12(13)17-23-16(14-7-3-4-10-24(14)17)18(25)22-15-8-9-20-11-21-15/h1-11,17,23H,(H,20,21,22,25)
InChIKeyZAALIOOWXOEARV-UHFFFAOYSA-N
XLogP2.45
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.34
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of 3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide (CID 90719550) is 3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for 3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for 3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide is O=C(Nc1ccncn1)C1=C2C=CC=CN2C(c2ccccc2F)N1.
What is the InChIKey of 3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is ZAALIOOWXOEARV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN5O/c19-13-6-2-1-5-12(13)17-23-16(14-7-3-4-10-24(14)17)18(25)22-15-8-9-20-11-21-15/h1-11,17,23H,(H,20,21,22,25).
What are the key properties of 3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide?
3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 335.34 g/mol, XLogP of 2.45, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-N-pyrimidin-4-yl-2,3-dihydroimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 90719550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).