5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C18H19FN6O — CID 67500573

IUPAC5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cnc3C)nc12
InChIInChI=1S/C18H19FN6O/c1-11-13(8-12(19)9-21-11)15-4-3-6-24(15)16-5-7-25-17(23-16)14(10-22-25)18(26)20-2/h5,7-10,15H,3-4,6H2,1-2H3,(H,20,26)/t15-/m1/s1
InChIKeyAYXUQBNBYRQZDH-OAHLLOKOSA-N
MW354.39 g/mol
LogP2.27
Rot. Bonds3

About 5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide

5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 67500573) has the molecular formula C18H19FN6O and a molecular weight of 354.39 g/mol. Its IUPAC name is 5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID67500573
Molecular FormulaC18H19FN6O
Molecular Weight354.39 g/mol
Exact Mass354.16
IUPAC Name5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cnc3C)nc12
InChIInChI=1S/C18H19FN6O/c1-11-13(8-12(19)9-21-11)15-4-3-6-24(15)16-5-7-25-17(23-16)14(10-22-25)18(26)20-2/h5,7-10,15H,3-4,6H2,1-2H3,(H,20,26)/t15-/m1/s1
InChIKeyAYXUQBNBYRQZDH-OAHLLOKOSA-N
XLogP2.27
TPSA75.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.39
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 67500573) is 5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide is CNC(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)cnc3C)nc12.
What is the InChIKey of 5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is AYXUQBNBYRQZDH-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H19FN6O/c1-11-13(8-12(19)9-21-11)15-4-3-6-24(15)16-5-7-25-17(23-16)14(10-22-25)18(26)20-2/h5,7-10,15H,3-4,6H2,1-2H3,(H,20,26)/t15-/m1/s1.
What are the key properties of 5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 354.39 g/mol, XLogP of 2.27, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2R)-2-(5-fluoro-2-methyl-3-pyridinyl)pyrrolidin-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 67500573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).