N-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide

C17H16FN5O — CID 162760808

IUPACN-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide
SMILESCCC(=O)Nc1cc(-c2cn(C)nc2-c2ccc(F)cn2)ccn1
InChIInChI=1S/C17H16FN5O/c1-3-16(24)21-15-8-11(6-7-19-15)13-10-23(2)22-17(13)14-5-4-12(18)9-20-14/h4-10H,3H2,1-2H3,(H,19,21,24)
InChIKeyGCGRJPHGTHHQEX-UHFFFAOYSA-N
MW325.35 g/mol
LogP3.03
Rot. Bonds4

About N-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide

N-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide (PubChem CID 162760808) has the molecular formula C17H16FN5O and a molecular weight of 325.35 g/mol. Its IUPAC name is N-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide.

Molecular Properties

Compound NameN-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide
PubChem CID162760808
Molecular FormulaC17H16FN5O
Molecular Weight325.35 g/mol
Exact Mass325.13
IUPAC NameN-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide
SMILESCCC(=O)Nc1cc(-c2cn(C)nc2-c2ccc(F)cn2)ccn1
InChIInChI=1S/C17H16FN5O/c1-3-16(24)21-15-8-11(6-7-19-15)13-10-23(2)22-17(13)14-5-4-12(18)9-20-14/h4-10H,3H2,1-2H3,(H,19,21,24)
InChIKeyGCGRJPHGTHHQEX-UHFFFAOYSA-N
XLogP3.03
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.35
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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N-[6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(pyridin-2-yl)pyrimidin-4-yl]-2-(4-methylpiperazin-1-yl)acetamide
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Frequently Asked Questions

What is the IUPAC name of N-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide?
The IUPAC name of N-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide (CID 162760808) is N-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide.
What is the SMILES notation for N-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide?
The canonical SMILES for N-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide is CCC(=O)Nc1cc(-c2cn(C)nc2-c2ccc(F)cn2)ccn1.
What is the InChIKey of N-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide?
The InChIKey is GCGRJPHGTHHQEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FN5O/c1-3-16(24)21-15-8-11(6-7-19-15)13-10-23(2)22-17(13)14-5-4-12(18)9-20-14/h4-10H,3H2,1-2H3,(H,19,21,24).
What are the key properties of N-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide?
N-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide has a molecular weight of 325.35 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-(5-fluoro-2-pyridinyl)-1-methylpyrazol-4-yl]-2-pyridinyl]propanamide is sourced from PubChem (CID 162760808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).