[3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone

C15H20N6O2 — CID 91914174

IUPAC[3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone
SMILESCN(C)c1nccnc1OC1CCN(C(=O)c2ccnn2C)C1
InChIInChI=1S/C15H20N6O2/c1-19(2)13-14(17-8-7-16-13)23-11-5-9-21(10-11)15(22)12-4-6-18-20(12)3/h4,6-8,11H,5,9-10H2,1-3H3
InChIKeyXHPDJKXBFUDYFA-UHFFFAOYSA-N
MW316.37 g/mol
LogP0.57
Rot. Bonds4

About [3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone

[3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone (PubChem CID 91914174) has the molecular formula C15H20N6O2 and a molecular weight of 316.37 g/mol. Its IUPAC name is [3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone.

Molecular Properties

Compound Name[3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone
PubChem CID91914174
Molecular FormulaC15H20N6O2
Molecular Weight316.37 g/mol
Exact Mass316.16
IUPAC Name[3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone
SMILESCN(C)c1nccnc1OC1CCN(C(=O)c2ccnn2C)C1
InChIInChI=1S/C15H20N6O2/c1-19(2)13-14(17-8-7-16-13)23-11-5-9-21(10-11)15(22)12-4-6-18-20(12)3/h4,6-8,11H,5,9-10H2,1-3H3
InChIKeyXHPDJKXBFUDYFA-UHFFFAOYSA-N
XLogP0.57
TPSA76.38 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.37
LogP ≤ 50.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

3-Ethoxy-N-[1-(1-ethyl-1H-pyrazole-5-carbonyl)piperidin-4-YL]pyrazin-2-amine
CID 87053003
(3-{[3-(Dimethylamino)pyrazin-2-YL]oxy}pyrrolidin-1-YL)(1H-pyrazol-3-YL)methanone
CID 91914184
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
1-Ethyl-N-[1-(3-methoxypyrazin-2-YL)pyrrolidin-3-YL]-N-methyl-1H-pyrazole-3-carboxamide
CID 53185734
(3-{[6-(Dimethylamino)-4-pyrimidinyl]oxy}-1-pyrrolidinyl)(1-methyl-1H-pyrazol-5-YL)methanone
CID 53185838
(1-Methyl-1H-pyrazol-5-YL)(3-{[6-(1-pyrrolidinyl)-4-pyrimidinyl]oxy}-1-pyrrolidinyl)methanone
CID 53185862

Frequently Asked Questions

What is the IUPAC name of [3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone?
The IUPAC name of [3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone (CID 91914174) is [3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone.
What is the SMILES notation for [3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone?
The canonical SMILES for [3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone is CN(C)c1nccnc1OC1CCN(C(=O)c2ccnn2C)C1.
What is the InChIKey of [3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone?
The InChIKey is XHPDJKXBFUDYFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O2/c1-19(2)13-14(17-8-7-16-13)23-11-5-9-21(10-11)15(22)12-4-6-18-20(12)3/h4,6-8,11H,5,9-10H2,1-3H3.
What are the key properties of [3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone?
[3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone has a molecular weight of 316.37 g/mol, XLogP of 0.57, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[3-(dimethylamino)pyrazin-2-yl]oxypyrrolidin-1-yl]-(2-methylpyrazol-3-yl)methanone is sourced from PubChem (CID 91914174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).