N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine

C21H17ClFN5 — CID 54669942

IUPACN-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine
SMILESFc1ccc(Cl)cc1-c1cc(Nc2ccnc3cn(CC4CC4)nc23)ccn1
InChIInChI=1S/C21H17ClFN5/c22-14-3-4-17(23)16(9-14)19-10-15(5-7-24-19)26-18-6-8-25-20-12-28(27-21(18)20)11-13-1-2-13/h3-10,12-13H,1-2,11H2,(H,24,26)
InChIKeyRTAJLCQGAOTHMJ-UHFFFAOYSA-N
MW393.85 g/mol
LogP5.44
Rot. Bonds5

About N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine

N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine (PubChem CID 54669942) has the molecular formula C21H17ClFN5 and a molecular weight of 393.85 g/mol. Its IUPAC name is N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine.

Molecular Properties

Compound NameN-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine
PubChem CID54669942
Molecular FormulaC21H17ClFN5
Molecular Weight393.85 g/mol
Exact Mass393.12
IUPAC NameN-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine
SMILESFc1ccc(Cl)cc1-c1cc(Nc2ccnc3cn(CC4CC4)nc23)ccn1
InChIInChI=1S/C21H17ClFN5/c22-14-3-4-17(23)16(9-14)19-10-15(5-7-24-19)26-18-6-8-25-20-12-28(27-21(18)20)11-13-1-2-13/h3-10,12-13H,1-2,11H2,(H,24,26)
InChIKeyRTAJLCQGAOTHMJ-UHFFFAOYSA-N
XLogP5.44
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.85
LogP ≤ 55.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine 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

Fauc 113
CID 10404144
N-[2-(5-Chloro-2-Fluorophenyl)pyridin-4-Yl]-2-[(Piperidin-4-Yl)methyl]-2h-Pyrazolo[4,3-B]pyridin-7-Amine
CID 54671256
N-(2-(2,5-difluorophenyl)-5-methylpyridin-4-yl)-1H-pyrazolo[4,3-b]pyridin-7-amine
CID 54671061
1-[[5-(4-Chloro-2-fluorophenyl)-2-pyridinyl]methyl]benzotriazole
CID 155519836
1-[[6-(4-Chloro-2-fluorophenyl)-3-pyridinyl]methyl]benzotriazole
CID 155540333
1-[[6-(4-Chlorophenyl)-3-pyridinyl]methyl]benzotriazole
CID 155546950
7-Chloro-2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo[1,5-a]pyridine
CID 9858407
3-(3-chlorophenyl)-2-(pyridin-4-yl)-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile
CID 42601406
3-(3-chloro-5-fluorophenyl)-2-(pyridin-4-yl)-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile
CID 44573174
3-(3-chloro-4-fluorophenyl)-2-(pyridin-4-yl)-1H-pyrrolo[3,2-b]pyridine-5-carbonitrile
CID 44573175
2-[7-[[2-(5-Chloro-2-fluorophenyl)-4-pyridinyl]amino]pyrazolo[4,3-b]pyridin-2-yl]acetamide
CID 54670034
N-(2-(5-chloro-2-fluorophenyl)-5-methylpyridin-4-yl)-1H-pyrazolo[4,3-b]pyridin-7-amine
CID 54670128

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine?
The IUPAC name of N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine (CID 54669942) is N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine.
What is the SMILES notation for N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine?
The canonical SMILES for N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine is Fc1ccc(Cl)cc1-c1cc(Nc2ccnc3cn(CC4CC4)nc23)ccn1.
What is the InChIKey of N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine?
The InChIKey is RTAJLCQGAOTHMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClFN5/c22-14-3-4-17(23)16(9-14)19-10-15(5-7-24-19)26-18-6-8-25-20-12-28(27-21(18)20)11-13-1-2-13/h3-10,12-13H,1-2,11H2,(H,24,26).
What are the key properties of N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine?
N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine has a molecular weight of 393.85 g/mol, XLogP of 5.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-(cyclopropylmethyl)pyrazolo[4,3-b]pyridin-7-amine is sourced from PubChem (CID 54669942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).