5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide

C15H18N4O3S — CID 131638609

IUPAC5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
SMILESCCOc1ccsc1C(=O)N1Cc2ccnn2C(C(=O)NC)C1
InChIInChI=1S/C15H18N4O3S/c1-3-22-12-5-7-23-13(12)15(21)18-8-10-4-6-17-19(10)11(9-18)14(20)16-2/h4-7,11H,3,8-9H2,1-2H3,(H,16,20)
InChIKeyRPKNKBYAQXHSNH-UHFFFAOYSA-N
MW334.40 g/mol
LogP1.29
Rot. Bonds4

About 5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide

5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide (PubChem CID 131638609) has the molecular formula C15H18N4O3S and a molecular weight of 334.40 g/mol. Its IUPAC name is 5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide.

Molecular Properties

Compound Name5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
PubChem CID131638609
Molecular FormulaC15H18N4O3S
Molecular Weight334.40 g/mol
Exact Mass334.11
IUPAC Name5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
SMILESCCOc1ccsc1C(=O)N1Cc2ccnn2C(C(=O)NC)C1
InChIInChI=1S/C15H18N4O3S/c1-3-22-12-5-7-23-13(12)15(21)18-8-10-4-6-17-19(10)11(9-18)14(20)16-2/h4-7,11H,3,8-9H2,1-2H3,(H,16,20)
InChIKeyRPKNKBYAQXHSNH-UHFFFAOYSA-N
XLogP1.29
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide with MolForge

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Related Compounds

(3-ethoxythiophen-2-yl)-[7-(methoxymethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]methanone
CID 133139940
5-(2-chloro-5-methoxybenzoyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
CID 131658315
5-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
CID 133142151
(7R)-5-(2-cyclopentylacetyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
CID 124800007
5-(2,3-dihydro-1,4-benzodioxine-5-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
CID 131646748
3-[1-(3-ethoxythiophene-2-carbonyl)piperidin-4-yl]-1,3-oxazolidin-2-one
CID 3416894
5-butanoyl-N-cyclopropyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
CID 131693163
(3-ethoxythiophen-2-yl)-[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]methanone
CID 3737844
N-cyclopentyl-5-(3-methylfuran-2-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
CID 131693042
[(3R,4R)-3-benzyl-4-methoxypiperidin-1-yl]-(3-ethoxythiophen-2-yl)methanone
CID 124790552
N-methyl-2-[5-(pyrazine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-7-yl]acetamide
CID 131693758
N-(2-methoxyethyl)-5-(3-methyl-1-benzofuran-2-carbonyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide
CID 131693135

Frequently Asked Questions

What is the IUPAC name of 5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide?
The IUPAC name of 5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide (CID 131638609) is 5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide.
What is the SMILES notation for 5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide?
The canonical SMILES for 5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide is CCOc1ccsc1C(=O)N1Cc2ccnn2C(C(=O)NC)C1.
What is the InChIKey of 5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide?
The InChIKey is RPKNKBYAQXHSNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O3S/c1-3-22-12-5-7-23-13(12)15(21)18-8-10-4-6-17-19(10)11(9-18)14(20)16-2/h4-7,11H,3,8-9H2,1-2H3,(H,16,20).
What are the key properties of 5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide?
5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide has a molecular weight of 334.40 g/mol, XLogP of 1.29, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-ethoxythiophene-2-carbonyl)-N-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-7-carboxamide is sourced from PubChem (CID 131638609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).