5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one

C20H20FN5O2 — CID 122541198

IUPAC5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one
SMILESCC(C)n1cc(-c2cn(-c3ccc(OCF)cc3)c(=O)c3c2ncn3C)cn1
InChIInChI=1S/C20H20FN5O2/c1-13(2)26-9-14(8-23-26)17-10-25(15-4-6-16(7-5-15)28-11-21)20(27)19-18(17)22-12-24(19)3/h4-10,12-13H,11H2,1-3H3
InChIKeyFTRHTYFTEHYENL-UHFFFAOYSA-N
MW381.41 g/mol
LogP3.47
Rot. Bonds5

About 5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one

5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one (PubChem CID 122541198) has the molecular formula C20H20FN5O2 and a molecular weight of 381.41 g/mol. Its IUPAC name is 5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one.

Molecular Properties

Compound Name5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one
PubChem CID122541198
Molecular FormulaC20H20FN5O2
Molecular Weight381.41 g/mol
Exact Mass381.16
IUPAC Name5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one
SMILESCC(C)n1cc(-c2cn(-c3ccc(OCF)cc3)c(=O)c3c2ncn3C)cn1
InChIInChI=1S/C20H20FN5O2/c1-13(2)26-9-14(8-23-26)17-10-25(15-4-6-16(7-5-15)28-11-21)20(27)19-18(17)22-12-24(19)3/h4-10,12-13H,11H2,1-3H3
InChIKeyFTRHTYFTEHYENL-UHFFFAOYSA-N
XLogP3.47
TPSA66.87 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.41
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one?
The IUPAC name of 5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one (CID 122541198) is 5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one.
What is the SMILES notation for 5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one?
The canonical SMILES for 5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one is CC(C)n1cc(-c2cn(-c3ccc(OCF)cc3)c(=O)c3c2ncn3C)cn1.
What is the InChIKey of 5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one?
The InChIKey is FTRHTYFTEHYENL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FN5O2/c1-13(2)26-9-14(8-23-26)17-10-25(15-4-6-16(7-5-15)28-11-21)20(27)19-18(17)22-12-24(19)3/h4-10,12-13H,11H2,1-3H3.
What are the key properties of 5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one?
5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one has a molecular weight of 381.41 g/mol, XLogP of 3.47, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(fluoromethoxy)phenyl]-3-methyl-7-(1-propan-2-ylpyrazol-4-yl)imidazo[4,5-c]pyridin-4-one is sourced from PubChem (CID 122541198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).