N-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine

C14H11ClFN3O — CID 167758225

IUPACN-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine
SMILESCOc1cc(Nc2ccc(F)c(Cl)c2)cn2nccc12
InChIInChI=1S/C14H11ClFN3O/c1-20-14-7-10(8-19-13(14)4-5-17-19)18-9-2-3-12(16)11(15)6-9/h2-8,18H,1H3
InChIKeyKEJLSDFKYRSHFV-UHFFFAOYSA-N
MW291.71 g/mol
LogP3.88
Rot. Bonds3

About N-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine

N-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine (PubChem CID 167758225) has the molecular formula C14H11ClFN3O and a molecular weight of 291.71 g/mol. Its IUPAC name is N-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine.

Molecular Properties

Compound NameN-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine
PubChem CID167758225
Molecular FormulaC14H11ClFN3O
Molecular Weight291.71 g/mol
Exact Mass291.06
IUPAC NameN-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine
SMILESCOc1cc(Nc2ccc(F)c(Cl)c2)cn2nccc12
InChIInChI=1S/C14H11ClFN3O/c1-20-14-7-10(8-19-13(14)4-5-17-19)18-9-2-3-12(16)11(15)6-9/h2-8,18H,1H3
InChIKeyKEJLSDFKYRSHFV-UHFFFAOYSA-N
XLogP3.88
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.71
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine?
The IUPAC name of N-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine (CID 167758225) is N-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine.
What is the SMILES notation for N-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine?
The canonical SMILES for N-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine is COc1cc(Nc2ccc(F)c(Cl)c2)cn2nccc12.
What is the InChIKey of N-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine?
The InChIKey is KEJLSDFKYRSHFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFN3O/c1-20-14-7-10(8-19-13(14)4-5-17-19)18-9-2-3-12(16)11(15)6-9/h2-8,18H,1H3.
What are the key properties of N-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine?
N-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine has a molecular weight of 291.71 g/mol, XLogP of 3.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-fluorophenyl)-4-methoxypyrazolo[1,5-a]pyridin-6-amine is sourced from PubChem (CID 167758225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).