N-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine

C19H15ClFN5 — CID 11596553

IUPACN-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine
SMILESCc1nn(C)c2cc(-c3ccc(F)cc3)nc(Nc3ccc(Cl)nc3)c12
InChIInChI=1S/C19H15ClFN5/c1-11-18-16(26(2)25-11)9-15(12-3-5-13(21)6-4-12)24-19(18)23-14-7-8-17(20)22-10-14/h3-10H,1-2H3,(H,23,24)
InChIKeyQLOAFONLPQHUOU-UHFFFAOYSA-N
MW367.82 g/mol
LogP4.87
Rot. Bonds3

About N-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine

N-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine (PubChem CID 11596553) has the molecular formula C19H15ClFN5 and a molecular weight of 367.82 g/mol. Its IUPAC name is N-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine.

Molecular Properties

Compound NameN-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine
PubChem CID11596553
Molecular FormulaC19H15ClFN5
Molecular Weight367.82 g/mol
Exact Mass367.10
IUPAC NameN-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine
SMILESCc1nn(C)c2cc(-c3ccc(F)cc3)nc(Nc3ccc(Cl)nc3)c12
InChIInChI=1S/C19H15ClFN5/c1-11-18-16(26(2)25-11)9-15(12-3-5-13(21)6-4-12)24-19(18)23-14-7-8-17(20)22-10-14/h3-10H,1-2H3,(H,23,24)
InChIKeyQLOAFONLPQHUOU-UHFFFAOYSA-N
XLogP4.87
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.82
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

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Amdizalisib
CID 118981804
6-chloro-7-(4-(4-chlorobenzyl)piperazin-1-yl)-2-(1,3-dimethyl-1H-pyrazol-4-yl)-3H-imidazo(4,5-b)pyridine
CID 71454279
Pyrazolo[1,5-b]pyridazine deriv. 30
CID 6539372
Pyrazolo[1,5-b]pyridazine deriv. 35
CID 6539377
Pyrazolo[1,5-b]pyridazine deriv. 36
CID 6539378
1-{6-[(3r)-4,4-Difluoropiperidin-3-Yl]pyridin-2-Yl}-6-(6-Methylpyrazin-2-Yl)-1h-Pyrazolo[4,3-C]pyridine
CID 89914568
5-(2-fluorophenyl)-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 21066096
Arylpyrazole, 28
CID 44143428
Arylpyrazole, 31
CID 44143431
4-[3-(3-Chloro-4-fluorophenyl)pyrazolo[1,5-a]pyrimidin-6-yl]pyridine
CID 5329464

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine?
The IUPAC name of N-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine (CID 11596553) is N-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine.
What is the SMILES notation for N-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine?
The canonical SMILES for N-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine is Cc1nn(C)c2cc(-c3ccc(F)cc3)nc(Nc3ccc(Cl)nc3)c12.
What is the InChIKey of N-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine?
The InChIKey is QLOAFONLPQHUOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClFN5/c1-11-18-16(26(2)25-11)9-15(12-3-5-13(21)6-4-12)24-19(18)23-14-7-8-17(20)22-10-14/h3-10H,1-2H3,(H,23,24).
What are the key properties of N-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine?
N-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine has a molecular weight of 367.82 g/mol, XLogP of 4.87, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-3-pyridinyl)-6-(4-fluorophenyl)-1,3-dimethylpyrazolo[4,3-c]pyridin-4-amine is sourced from PubChem (CID 11596553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).