6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide

C20H18N6O2 — CID 178051423

IUPAC6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
SMILESCc1nc(-c2ccc(C)c(NC(=O)c3cnn4cc(C5CC5)ncc34)c2)no1
InChIInChI=1S/C20H18N6O2/c1-11-3-4-14(19-23-12(2)28-25-19)7-16(11)24-20(27)15-8-22-26-10-17(13-5-6-13)21-9-18(15)26/h3-4,7-10,13H,5-6H2,1-2H3,(H,24,27)
InChIKeyOTPNGIOEGYWGQC-UHFFFAOYSA-N
MW374.40 g/mol
LogP3.53
Rot. Bonds4

About 6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide

6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide (PubChem CID 178051423) has the molecular formula C20H18N6O2 and a molecular weight of 374.40 g/mol. Its IUPAC name is 6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
PubChem CID178051423
Molecular FormulaC20H18N6O2
Molecular Weight374.40 g/mol
Exact Mass374.15
IUPAC Name6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide
SMILESCc1nc(-c2ccc(C)c(NC(=O)c3cnn4cc(C5CC5)ncc34)c2)no1
InChIInChI=1S/C20H18N6O2/c1-11-3-4-14(19-23-12(2)28-25-19)7-16(11)24-20(27)15-8-22-26-10-17(13-5-6-13)21-9-18(15)26/h3-4,7-10,13H,5-6H2,1-2H3,(H,24,27)
InChIKeyOTPNGIOEGYWGQC-UHFFFAOYSA-N
XLogP3.53
TPSA98.21 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
The IUPAC name of 6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide (CID 178051423) is 6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide is Cc1nc(-c2ccc(C)c(NC(=O)c3cnn4cc(C5CC5)ncc34)c2)no1.
What is the InChIKey of 6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
The InChIKey is OTPNGIOEGYWGQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N6O2/c1-11-3-4-14(19-23-12(2)28-25-19)7-16(11)24-20(27)15-8-22-26-10-17(13-5-6-13)21-9-18(15)26/h3-4,7-10,13H,5-6H2,1-2H3,(H,24,27).
What are the key properties of 6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide?
6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide has a molecular weight of 374.40 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]pyrazolo[1,5-a]pyrazine-3-carboxamide is sourced from PubChem (CID 178051423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).