(4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide

C24H27FN6O — CID 175779934

IUPAC(4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide
SMILESCCNC(=O)N1CC[C@]2(CCCn3nc(-c4cnc(N)c(-c5ccccc5F)c4)cc32)C1
InChIInChI=1S/C24H27FN6O/c1-2-27-23(32)30-11-9-24(15-30)8-5-10-31-21(24)13-20(29-31)16-12-18(22(26)28-14-16)17-6-3-4-7-19(17)25/h3-4,6-7,12-14H,2,5,8-11,15H2,1H3,(H2,26,28)(H,27,32)/t24-/m1/s1
InChIKeyFPZUHABBILUWSC-XMMPIXPASA-N
MW434.52 g/mol
LogP3.80
Rot. Bonds3

About (4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide

(4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide (PubChem CID 175779934) has the molecular formula C24H27FN6O and a molecular weight of 434.52 g/mol. Its IUPAC name is (4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide.

Molecular Properties

Compound Name(4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide
PubChem CID175779934
Molecular FormulaC24H27FN6O
Molecular Weight434.52 g/mol
Exact Mass434.22
IUPAC Name(4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide
SMILESCCNC(=O)N1CC[C@]2(CCCn3nc(-c4cnc(N)c(-c5ccccc5F)c4)cc32)C1
InChIInChI=1S/C24H27FN6O/c1-2-27-23(32)30-11-9-24(15-30)8-5-10-31-21(24)13-20(29-31)16-12-18(22(26)28-14-16)17-6-3-4-7-19(17)25/h3-4,6-7,12-14H,2,5,8-11,15H2,1H3,(H2,26,28)(H,27,32)/t24-/m1/s1
InChIKeyFPZUHABBILUWSC-XMMPIXPASA-N
XLogP3.80
TPSA89.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.52
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of (4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide?
The IUPAC name of (4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide (CID 175779934) is (4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide.
What is the SMILES notation for (4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide?
The canonical SMILES for (4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide is CCNC(=O)N1CC[C@]2(CCCn3nc(-c4cnc(N)c(-c5ccccc5F)c4)cc32)C1.
What is the InChIKey of (4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide?
The InChIKey is FPZUHABBILUWSC-XMMPIXPASA-N. The full InChI is InChI=1S/C24H27FN6O/c1-2-27-23(32)30-11-9-24(15-30)8-5-10-31-21(24)13-20(29-31)16-12-18(22(26)28-14-16)17-6-3-4-7-19(17)25/h3-4,6-7,12-14H,2,5,8-11,15H2,1H3,(H2,26,28)(H,27,32)/t24-/m1/s1.
What are the key properties of (4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide?
(4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide has a molecular weight of 434.52 g/mol, XLogP of 3.80, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-[6-amino-5-(2-fluorophenyl)-3-pyridinyl]-N-ethylspiro[6,7-dihydro-5H-pyrazolo[1,5-a]pyridine-4,3'-pyrrolidine]-1'-carboxamide is sourced from PubChem (CID 175779934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).