(1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone

C16H22N6O2 — CID 87052983

IUPAC(1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone
SMILESCCn1ccc(C(=O)N2CCC(Nc3nccnc3OC)CC2)n1
InChIInChI=1S/C16H22N6O2/c1-3-22-11-6-13(20-22)16(23)21-9-4-12(5-10-21)19-14-15(24-2)18-8-7-17-14/h6-8,11-12H,3-5,9-10H2,1-2H3,(H,17,19)
InChIKeyWWGQBQVMKNKKRZ-UHFFFAOYSA-N
MW330.39 g/mol
LogP1.42
Rot. Bonds5

About (1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone

(1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone (PubChem CID 87052983) has the molecular formula C16H22N6O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is (1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone.

Molecular Properties

Compound Name(1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone
PubChem CID87052983
Molecular FormulaC16H22N6O2
Molecular Weight330.39 g/mol
Exact Mass330.18
IUPAC Name(1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone
SMILESCCn1ccc(C(=O)N2CCC(Nc3nccnc3OC)CC2)n1
InChIInChI=1S/C16H22N6O2/c1-3-22-11-6-13(20-22)16(23)21-9-4-12(5-10-21)19-14-15(24-2)18-8-7-17-14/h6-8,11-12H,3-5,9-10H2,1-2H3,(H,17,19)
InChIKeyWWGQBQVMKNKKRZ-UHFFFAOYSA-N
XLogP1.42
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze (1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone with MolForge

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Related Compounds

6-Methoxy-3-(pyrimidin-5-ylamino)-pyrazine-2-carboxylic acid (1-methyl-5-methylcarbamoyl-1H-pyrazol-4-yl)-amide
CID 54759459
3-Ethoxy-N-[1-(1-ethyl-1H-pyrazole-5-carbonyl)piperidin-4-YL]pyrazin-2-amine
CID 87053003
[2-[3-(methylamino)pyrazin-2-yl]morpholin-4-yl]-(1H-pyrazol-5-yl)methanone
CID 110112869
(1-Methylpyrazol-3-yl)-[3-(pyrazin-2-ylamino)-1-oxa-8-azaspiro[4.5]decan-8-yl]methanone
CID 118740735
N,N-Dimethyl-3-{[1-(1-methyl-1H-pyrazole-5-carbonyl)pyrrolidin-3-YL]oxy}pyrazin-2-amine
CID 91914174
N-[1-(1-Ethyl-1H-pyrazole-5-carbonyl)piperidin-4-YL]-3-methoxypyrazin-2-amine
CID 53185570
[3-({3-[methyl(propyl)amino]-2-pyrazinyl}oxy)-1-pyrrolidinyl](1H-pyrazol-3-yl)methanone
CID 91904388
3-Methoxy-N-[1-(1-methyl-1H-pyrazole-5-carbonyl)piperidin-4-YL]pyrazin-2-amine
CID 53185569
1-ethyl-N-[1-(3-methoxy-2-pyrazinyl)tetrahydro-1H-pyrrol-3-yl]-1H-pyrazole-5-carboxamide
CID 53185629
N~5~-[1-(3-Ethoxy-2-pyrazinyl)tetrahydro-1H-pyrrol-3-YL]-N~5~,1-dimethyl-1H-pyrazole-5-carboxamide
CID 53185707
N-[1-(3-Ethoxypyrazin-2-YL)pyrrolidin-3-YL]-1-ethyl-N-methyl-1H-pyrazole-5-carboxamide
CID 53185708
N~5~-[1-(3-Methoxy-2-pyrazinyl)tetrahydro-1H-pyrrol-3-YL]-N~5~,1-dimethyl-1H-pyrazole-5-carboxamide
CID 53185733

Frequently Asked Questions

What is the IUPAC name of (1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone?
The IUPAC name of (1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone (CID 87052983) is (1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone.
What is the SMILES notation for (1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone?
The canonical SMILES for (1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone is CCn1ccc(C(=O)N2CCC(Nc3nccnc3OC)CC2)n1.
What is the InChIKey of (1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone?
The InChIKey is WWGQBQVMKNKKRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N6O2/c1-3-22-11-6-13(20-22)16(23)21-9-4-12(5-10-21)19-14-15(24-2)18-8-7-17-14/h6-8,11-12H,3-5,9-10H2,1-2H3,(H,17,19).
What are the key properties of (1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone?
(1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone has a molecular weight of 330.39 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylpyrazol-3-yl)-[4-[(3-methoxypyrazin-2-yl)amino]piperidin-1-yl]methanone is sourced from PubChem (CID 87052983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).