[3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone

C15H17FN4O — CID 175726957

IUPAC[3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone
SMILESCc1cc(-c2cc(C(=O)N3CCCCC3)[nH]n2)c(F)cn1
InChIInChI=1S/C15H17FN4O/c1-10-7-11(12(16)9-17-10)13-8-14(19-18-13)15(21)20-5-3-2-4-6-20/h7-9H,2-6H2,1H3,(H,18,19)
InChIKeyOHNFVVCYMZWLON-UHFFFAOYSA-N
MW288.33 g/mol
LogP2.55
Rot. Bonds2

About [3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone

[3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone (PubChem CID 175726957) has the molecular formula C15H17FN4O and a molecular weight of 288.33 g/mol. Its IUPAC name is [3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone
PubChem CID175726957
Molecular FormulaC15H17FN4O
Molecular Weight288.33 g/mol
Exact Mass288.14
IUPAC Name[3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone
SMILESCc1cc(-c2cc(C(=O)N3CCCCC3)[nH]n2)c(F)cn1
InChIInChI=1S/C15H17FN4O/c1-10-7-11(12(16)9-17-10)13-8-14(19-18-13)15(21)20-5-3-2-4-6-20/h7-9H,2-6H2,1H3,(H,18,19)
InChIKeyOHNFVVCYMZWLON-UHFFFAOYSA-N
XLogP2.55
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Launch Full Analysis

Related Compounds

methyl 3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazole-5-carboxylate
CID 163295198
4-azaspiro[2.5]octan-4-yl-[3-(2-ethyl-5-fluoro-4-pyridinyl)-1H-pyrazol-5-yl]methanone
CID 163294693
1-[3-(5-fluoro-2-methoxy-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-(4-hydroxy-1-bicyclo[2.2.1]heptanyl)piperidine-4-carboxamide
CID 169006169
(1S,5R)-8-[3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-[(3R,6R)-6-(trifluoromethyl)oxan-3-yl]-8-azabicyclo[3.2.1]octane-3-carboxamide
CID 167064756
N-[(3-chlorophenyl)methyl]-8-[3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-8-azabicyclo[3.2.1]octane-3-carboxamide
CID 167375356
(7S)-4-[3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-N-[4-methoxy-4-(trifluoromethyl)cyclohexyl]-4-azaspiro[2.5]octane-7-carboxamide
CID 163295021
azepan-1-yl-[3-(4-ethoxyphenyl)-1H-pyrazol-5-yl]methanone
CID 20918147
[(5R)-8-azabicyclo[3.2.1]octan-8-yl]-[3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]methanone;N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]formamide
CID 163295536
(7R)-N-[4-ethoxy-4-(trifluoromethyl)cyclohexyl]-4-[3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-4-azaspiro[2.5]octane-7-carboxamide
CID 163295710
[4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl]-(2-fluorophenyl)methanone
CID 20910921
2-[(3-chloro-5-methoxy-2-pyridinyl)methyl]-4-[3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazole-5-carbonyl]-4-azaspiro[2.5]octane-7-carboxamide
CID 175726882
azepan-1-yl-[3-(3-chlorophenyl)-1H-pyrazol-5-yl]methanone
CID 46920429

Frequently Asked Questions

What is the IUPAC name of [3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone?
The IUPAC name of [3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone (CID 175726957) is [3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone.
What is the SMILES notation for [3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone?
The canonical SMILES for [3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone is Cc1cc(-c2cc(C(=O)N3CCCCC3)[nH]n2)c(F)cn1.
What is the InChIKey of [3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone?
The InChIKey is OHNFVVCYMZWLON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN4O/c1-10-7-11(12(16)9-17-10)13-8-14(19-18-13)15(21)20-5-3-2-4-6-20/h7-9H,2-6H2,1H3,(H,18,19).
What are the key properties of [3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone?
[3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone has a molecular weight of 288.33 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(5-fluoro-2-methyl-4-pyridinyl)-1H-pyrazol-5-yl]-piperidin-1-ylmethanone is sourced from PubChem (CID 175726957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).