3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine

C22H16FN7 — CID 137032977

IUPAC3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine
SMILESC/C=C(/c1ccc(F)cc1)c1cnc(-c2n[nH]c3ccc(-c4cncnc4)nc23)[nH]1
InChIInChI=1S/C22H16FN7/c1-2-16(13-3-5-15(23)6-4-13)19-11-26-22(28-19)21-20-18(29-30-21)8-7-17(27-20)14-9-24-12-25-10-14/h2-12H,1H3,(H,26,28)(H,29,30)/b16-2-
InChIKeyHPYBLKWWKVTNSZ-CFZMTHNTSA-N
MW397.42 g/mol
LogP4.40
Rot. Bonds4

About 3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine

3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine (PubChem CID 137032977) has the molecular formula C22H16FN7 and a molecular weight of 397.42 g/mol. Its IUPAC name is 3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine.

Molecular Properties

Compound Name3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine
PubChem CID137032977
Molecular FormulaC22H16FN7
Molecular Weight397.42 g/mol
Exact Mass397.15
IUPAC Name3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine
SMILESC/C=C(/c1ccc(F)cc1)c1cnc(-c2n[nH]c3ccc(-c4cncnc4)nc23)[nH]1
InChIInChI=1S/C22H16FN7/c1-2-16(13-3-5-15(23)6-4-13)19-11-26-22(28-19)21-20-18(29-30-21)8-7-17(27-20)14-9-24-12-25-10-14/h2-12H,1H3,(H,26,28)(H,29,30)/b16-2-
InChIKeyHPYBLKWWKVTNSZ-CFZMTHNTSA-N
XLogP4.40
TPSA96.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.42
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine with MolForge

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

Launch Full Analysis

Related Compounds

3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-pyrazolo[4,3-b]pyridine
CID 137032845
3-[4-(5-fluorothiophen-2-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine
CID 137038810
3-[4-(2-fluorophenyl)-1H-benzimidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine
CID 137109052
3-[4-(3-fluoro-5-methoxyphenyl)-1H-benzimidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine
CID 137087522
5-[3-[4-(4-fluorophenyl)-1H-imidazo[4,5-c]pyridin-2-yl]-1H-pyrazolo[4,3-b]pyridin-5-yl]pyridin-3-amine
CID 137038943
3-[5-methyl-4-[(1Z)-1-pyridin-4-ylbuta-1,3-dienyl]-1H-imidazol-2-yl]-5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridine
CID 145253097
1-[5-[2-(5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-1H-imidazo[4,5-b]pyridin-7-yl]thiophen-2-yl]ethanone
CID 137041993
3-[7-(furan-3-yl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine
CID 137313146
2-(5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
CID 137110531
3-[7-(4-fluorophenyl)-1H-imidazo[4,5-b]pyridin-2-yl]-5-(4-methyl-3-pyridinyl)-1H-pyrazolo[4,3-b]pyridine
CID 137041930
3-[4-(1,3-benzodioxol-5-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine
CID 137038963
3-[7-[3-fluoro-5-(2-pyrrolidin-1-ylethoxy)phenyl]-3H-imidazo[4,5-c]pyridin-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine
CID 137312072

Frequently Asked Questions

What is the IUPAC name of 3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine?
The IUPAC name of 3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine (CID 137032977) is 3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine.
What is the SMILES notation for 3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine?
The canonical SMILES for 3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine is C/C=C(/c1ccc(F)cc1)c1cnc(-c2n[nH]c3ccc(-c4cncnc4)nc23)[nH]1.
What is the InChIKey of 3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine?
The InChIKey is HPYBLKWWKVTNSZ-CFZMTHNTSA-N. The full InChI is InChI=1S/C22H16FN7/c1-2-16(13-3-5-15(23)6-4-13)19-11-26-22(28-19)21-20-18(29-30-21)8-7-17(27-20)14-9-24-12-25-10-14/h2-12H,1H3,(H,26,28)(H,29,30)/b16-2-.
What are the key properties of 3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine?
3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine has a molecular weight of 397.42 g/mol, XLogP of 4.40, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-[(Z)-1-(4-fluorophenyl)prop-1-enyl]-1H-imidazol-2-yl]-5-pyrimidin-5-yl-1H-pyrazolo[4,3-b]pyridine is sourced from PubChem (CID 137032977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).