1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone

C15H19N5O — CID 110102442

IUPAC1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(c2cnc(-c3cn[nH]c3C)cn2)CC1
InChIInChI=1S/C15H19N5O/c1-10-13(7-18-19-10)15-9-16-14(8-17-15)12-3-5-20(6-4-12)11(2)21/h7-9,12H,3-6H2,1-2H3,(H,18,19)
InChIKeyKOJTVZCGIHWKST-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.90
Rot. Bonds2

About 1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone

1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone (PubChem CID 110102442) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
PubChem CID110102442
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(c2cnc(-c3cn[nH]c3C)cn2)CC1
InChIInChI=1S/C15H19N5O/c1-10-13(7-18-19-10)15-9-16-14(8-17-15)12-3-5-20(6-4-12)11(2)21/h7-9,12H,3-6H2,1-2H3,(H,18,19)
InChIKeyKOJTVZCGIHWKST-UHFFFAOYSA-N
XLogP1.90
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(3S)-3-[[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]methyl]pyrrolidin-1-yl]ethanone
CID 124971600
2,2-dimethyl-1-[4-[[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]methyl]piperidin-1-yl]propan-1-one
CID 110102368
1-[3-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 110101486
1-[4-[5-(4-methylpiperidin-1-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 95824950
2-(5-methyl-1H-pyrazol-4-yl)-6-(1-methylsulfonylpiperidin-4-yl)pyrazine
CID 110102242
1-acetyl-N-(5-methyl-1H-pyrazol-3-yl)piperidine-4-carboxamide
CID 60973723
1-[4-[(3S)-3-(4-methylsulfonyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]piperidin-1-yl]ethanone
CID 124947578
1-[4-(5-pyrimidin-5-yl-2-pyridinyl)piperidin-1-yl]ethanone
CID 95834066
1-[3-[5-(2-ethylpyrazol-3-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 110101484
1-[4-[2-[6-(5-methyl-1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperazin-1-yl]ethanone
CID 139359521
cis-(1S,2R)-2-[4-(5-methyl-1H-pyrazol-4-yl)piperidine-1-carbonyl]cyclobutane-1-carboxylic acid
CID 167872863
1-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]ethanone
CID 134601157

Frequently Asked Questions

What is the IUPAC name of 1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone?
The IUPAC name of 1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone (CID 110102442) is 1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone?
The canonical SMILES for 1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone is CC(=O)N1CCC(c2cnc(-c3cn[nH]c3C)cn2)CC1.
What is the InChIKey of 1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone?
The InChIKey is KOJTVZCGIHWKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-10-13(7-18-19-10)15-9-16-14(8-17-15)12-3-5-20(6-4-12)11(2)21/h7-9,12H,3-6H2,1-2H3,(H,18,19).
What are the key properties of 1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone?
1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone has a molecular weight of 285.35 g/mol, XLogP of 1.90, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[5-(5-methyl-1H-pyrazol-4-yl)pyrazin-2-yl]piperidin-1-yl]ethanone is sourced from PubChem (CID 110102442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).