2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide

C16H25N7O2 — CID 56886771

IUPAC2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide
SMILESCCc1nc(CN(C)Cc2cc3n(n2)CCN(C(=O)N(C)C)C3)no1
InChIInChI=1S/C16H25N7O2/c1-5-15-17-14(19-25-15)11-21(4)9-12-8-13-10-22(16(24)20(2)3)6-7-23(13)18-12/h8H,5-7,9-11H2,1-4H3
InChIKeyRDZABQXKARPUCD-UHFFFAOYSA-N
MW347.42 g/mol
LogP0.96
Rot. Bonds5

About 2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide

2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide (PubChem CID 56886771) has the molecular formula C16H25N7O2 and a molecular weight of 347.42 g/mol. Its IUPAC name is 2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide.

Molecular Properties

Compound Name2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide
PubChem CID56886771
Molecular FormulaC16H25N7O2
Molecular Weight347.42 g/mol
Exact Mass347.21
IUPAC Name2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide
SMILESCCc1nc(CN(C)Cc2cc3n(n2)CCN(C(=O)N(C)C)C3)no1
InChIInChI=1S/C16H25N7O2/c1-5-15-17-14(19-25-15)11-21(4)9-12-8-13-10-22(16(24)20(2)3)6-7-23(13)18-12/h8H,5-7,9-11H2,1-4H3
InChIKeyRDZABQXKARPUCD-UHFFFAOYSA-N
XLogP0.96
TPSA83.53 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide?
The IUPAC name of 2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide (CID 56886771) is 2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide.
What is the SMILES notation for 2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide?
The canonical SMILES for 2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide is CCc1nc(CN(C)Cc2cc3n(n2)CCN(C(=O)N(C)C)C3)no1.
What is the InChIKey of 2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide?
The InChIKey is RDZABQXKARPUCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N7O2/c1-5-15-17-14(19-25-15)11-21(4)9-12-8-13-10-22(16(24)20(2)3)6-7-23(13)18-12/h8H,5-7,9-11H2,1-4H3.
What are the key properties of 2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide?
2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide has a molecular weight of 347.42 g/mol, XLogP of 0.96, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl-methylamino]methyl]-N,N-dimethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine-5-carboxamide is sourced from PubChem (CID 56886771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).