N-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine

C18H13ClFN5 — CID 54670128

IUPACN-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine
SMILESCc1cnc(-c2cc(Cl)ccc2F)cc1Nc1ccnc2cn[nH]c12
InChIInChI=1S/C18H13ClFN5/c1-10-8-22-16(12-6-11(19)2-3-13(12)20)7-15(10)24-14-4-5-21-17-9-23-25-18(14)17/h2-9H,1H3,(H,23,25)(H,21,22,24)
InChIKeyOXSDTRSIBXBIJL-UHFFFAOYSA-N
MW353.79 g/mol
LogP4.86
Rot. Bonds3

About N-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine

N-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine (PubChem CID 54670128) has the molecular formula C18H13ClFN5 and a molecular weight of 353.79 g/mol. Its IUPAC name is N-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine.

Molecular Properties

Compound NameN-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine
PubChem CID54670128
Molecular FormulaC18H13ClFN5
Molecular Weight353.79 g/mol
Exact Mass353.08
IUPAC NameN-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine
SMILESCc1cnc(-c2cc(Cl)ccc2F)cc1Nc1ccnc2cn[nH]c12
InChIInChI=1S/C18H13ClFN5/c1-10-8-22-16(12-6-11(19)2-3-13(12)20)7-15(10)24-14-4-5-21-17-9-23-25-18(14)17/h2-9H,1H3,(H,23,25)(H,21,22,24)
InChIKeyOXSDTRSIBXBIJL-UHFFFAOYSA-N
XLogP4.86
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.79
LogP ≤ 54.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine
CID 54671064
4-(1H-pyrazolo[4,3-b]pyridin-7-ylamino)phenol
CID 135999292
7-[[2-(2,5-difluorophenyl)-5-methyl-4-pyridinyl]amino]-N-ethylpyrazolo[4,3-b]pyridine-1-carboxamide
CID 67470617
N-[(5-methyl-1H-pyrazol-3-yl)methyl]-1H-pyrazolo[4,3-b]pyridin-7-amine
CID 138692707
1-[7-[[2-(2,5-difluorophenyl)-5-methyl-4-pyridinyl]amino]pyrazolo[4,3-b]pyridin-1-yl]propan-2-ol
CID 67470405
N-[2-(5-chloro-2-fluorophenyl)-5-propan-2-yl-4-pyridinyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
CID 118211266
5-[7-[[2-(2,5-difluorophenyl)-5-methyl-4-pyridinyl]amino]pyrazolo[4,3-b]pyridin-2-yl]pentan-2-ol
CID 67470441
N-[2-(5-chloro-2-fluorophenyl)-5-prop-1-en-2-yl-4-pyridinyl]quinolin-5-amine
CID 118211354
[4-[[2-(5-chloro-2-fluorophenyl)-5-propan-2-yl-4-pyridinyl]amino]-3-pyridinyl]methanol
CID 118211486
methyl 4-[[5-bromo-2-(5-chloro-2-fluorophenyl)-4-pyridinyl]amino]pyridine-3-carboxylate
CID 118211432
3-(5-chloro-2-fluorophenyl)-6-methylsulfanyl-5-(1H-pyrazolo[3,4-b]pyridin-4-ylamino)-1H-pyridin-2-one
CID 146299041
methyl 4-[[2-(5-chloro-2-fluorophenyl)-5-propan-2-yl-4-pyridinyl]amino]pyridine-3-carboxylate
CID 118211355

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine?
The IUPAC name of N-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine (CID 54670128) is N-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine.
What is the SMILES notation for N-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine?
The canonical SMILES for N-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine is Cc1cnc(-c2cc(Cl)ccc2F)cc1Nc1ccnc2cn[nH]c12.
What is the InChIKey of N-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine?
The InChIKey is OXSDTRSIBXBIJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13ClFN5/c1-10-8-22-16(12-6-11(19)2-3-13(12)20)7-15(10)24-14-4-5-21-17-9-23-25-18(14)17/h2-9H,1H3,(H,23,25)(H,21,22,24).
What are the key properties of N-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine?
N-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine has a molecular weight of 353.79 g/mol, XLogP of 4.86, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-chloro-2-fluorophenyl)-5-methyl-4-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-7-amine is sourced from PubChem (CID 54670128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).