4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine

C20H15ClFN5 — CID 10110282

IUPAC4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine
SMILESFc1ccc(-c2nn3c(Cl)cccc3c2-c2ccnc(NC3CC3)n2)cc1
InChIInChI=1S/C20H15ClFN5/c21-17-3-1-2-16-18(15-10-11-23-20(25-15)24-14-8-9-14)19(26-27(16)17)12-4-6-13(22)7-5-12/h1-7,10-11,14H,8-9H2,(H,23,24,25)
InChIKeyUPZNIWHYDALZKC-UHFFFAOYSA-N
MW379.83 g/mol
LogP4.83
Rot. Bonds4

About 4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine

4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine (PubChem CID 10110282) has the molecular formula C20H15ClFN5 and a molecular weight of 379.83 g/mol. Its IUPAC name is 4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine.

Molecular Properties

Compound Name4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine
PubChem CID10110282
Molecular FormulaC20H15ClFN5
Molecular Weight379.83 g/mol
Exact Mass379.10
IUPAC Name4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine
SMILESFc1ccc(-c2nn3c(Cl)cccc3c2-c2ccnc(NC3CC3)n2)cc1
InChIInChI=1S/C20H15ClFN5/c21-17-3-1-2-16-18(15-10-11-23-20(25-15)24-14-8-9-14)19(26-27(16)17)12-4-6-13(22)7-5-12/h1-7,10-11,14H,8-9H2,(H,23,24,25)
InChIKeyUPZNIWHYDALZKC-UHFFFAOYSA-N
XLogP4.83
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.83
LogP ≤ 54.83
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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Frequently Asked Questions

What is the IUPAC name of 4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine?
The IUPAC name of 4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine (CID 10110282) is 4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine.
What is the SMILES notation for 4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine?
The canonical SMILES for 4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine is Fc1ccc(-c2nn3c(Cl)cccc3c2-c2ccnc(NC3CC3)n2)cc1.
What is the InChIKey of 4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine?
The InChIKey is UPZNIWHYDALZKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClFN5/c21-17-3-1-2-16-18(15-10-11-23-20(25-15)24-14-8-9-14)19(26-27(16)17)12-4-6-13(22)7-5-12/h1-7,10-11,14H,8-9H2,(H,23,24,25).
What are the key properties of 4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine?
4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine has a molecular weight of 379.83 g/mol, XLogP of 4.83, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[7-chloro-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-cyclopropylpyrimidin-2-amine is sourced from PubChem (CID 10110282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).