5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine

C13H15FN4O — CID 66865744

IUPAC5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine
SMILESCOc1ncc(F)cc1C1CCCN1c1ccn[nH]1
InChIInChI=1S/C13H15FN4O/c1-19-13-10(7-9(14)8-15-13)11-3-2-6-18(11)12-4-5-16-17-12/h4-5,7-8,11H,2-3,6H2,1H3,(H,16,17)
InChIKeyLFOZFGALKMOMML-UHFFFAOYSA-N
MW262.29 g/mol
LogP2.29
Rot. Bonds3

About 5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine

5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine (PubChem CID 66865744) has the molecular formula C13H15FN4O and a molecular weight of 262.29 g/mol. Its IUPAC name is 5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine.

Molecular Properties

Compound Name5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine
PubChem CID66865744
Molecular FormulaC13H15FN4O
Molecular Weight262.29 g/mol
Exact Mass262.12
IUPAC Name5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine
SMILESCOc1ncc(F)cc1C1CCCN1c1ccn[nH]1
InChIInChI=1S/C13H15FN4O/c1-19-13-10(7-9(14)8-15-13)11-3-2-6-18(11)12-4-5-16-17-12/h4-5,7-8,11H,2-3,6H2,1H3,(H,16,17)
InChIKeyLFOZFGALKMOMML-UHFFFAOYSA-N
XLogP2.29
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.29
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2-methoxyphenyl)-N-(1H-pyrazol-5-yl)pyrimidin-4-amine
CID 3235003
N-[4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-yl]-4-pyrrolidin-1-ylbutanamide
CID 44621015
N-[4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-yl]-2,2-dimethyl-4-pyrrolidin-1-ylbutanamide
CID 44621104
N-[4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-yl]-3,3-dimethyl-4-pyrrolidin-1-ylbutanamide
CID 44621183
N-[4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-yl]-3-methyl-4-pyrrolidin-1-ylbutanamide
CID 45107225
6-[3-(6-Methoxy-pyridin-3-yl)-5-trifluoromethyl-pyrazol-1-yl]-pyridazin-3-ylamine
CID 57861929
N-[4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-yl]-2-methyl-4-pyrrolidin-1-ylbutanamide
CID 59333099
2-[(2-fluorophenyl)methyl]-5-(6-methoxy-3-pyridinyl)-3-(1H-pyrazol-5-yl)-4H-pyrimidine
CID 66631969
5-fluoro-2-methoxy-3-[(2R)-1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine
CID 66865051
3-[(2R)-1-[2-(2-chloroethoxy)pyrazol-3-yl]pyrrolidin-2-yl]-5-fluoro-2-methoxypyridine
CID 66869068
4-Fluoro-5-(6-methoxy-pyridin-3-yl)-2H-pyrazol-3-ylamine
CID 67187364
5-[2-(5-fluoro-2-methoxy-pyridin-4-yl)ethyl]-1H-pyrazol-3-amine
CID 68876782

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine?
The IUPAC name of 5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine (CID 66865744) is 5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine.
What is the SMILES notation for 5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine?
The canonical SMILES for 5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine is COc1ncc(F)cc1C1CCCN1c1ccn[nH]1.
What is the InChIKey of 5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine?
The InChIKey is LFOZFGALKMOMML-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN4O/c1-19-13-10(7-9(14)8-15-13)11-3-2-6-18(11)12-4-5-16-17-12/h4-5,7-8,11H,2-3,6H2,1H3,(H,16,17).
What are the key properties of 5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine?
5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine has a molecular weight of 262.29 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methoxy-3-[1-(1H-pyrazol-5-yl)pyrrolidin-2-yl]pyridine is sourced from PubChem (CID 66865744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).