2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide

C15H21N7O — CID 56781632

IUPAC2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide
SMILESCc1cc(NC(=O)CN2CCn3c(nnc3C3CC3)C2)n(C)n1
InChIInChI=1S/C15H21N7O/c1-10-7-12(20(2)19-10)16-14(23)9-21-5-6-22-13(8-21)17-18-15(22)11-3-4-11/h7,11H,3-6,8-9H2,1-2H3,(H,16,23)
InChIKeyNVTOPXAKOXVGRY-UHFFFAOYSA-N
MW315.38 g/mol
LogP0.65
Rot. Bonds4

About 2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide

2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide (PubChem CID 56781632) has the molecular formula C15H21N7O and a molecular weight of 315.38 g/mol. Its IUPAC name is 2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide
PubChem CID56781632
Molecular FormulaC15H21N7O
Molecular Weight315.38 g/mol
Exact Mass315.18
IUPAC Name2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide
SMILESCc1cc(NC(=O)CN2CCn3c(nnc3C3CC3)C2)n(C)n1
InChIInChI=1S/C15H21N7O/c1-10-7-12(20(2)19-10)16-14(23)9-21-5-6-22-13(8-21)17-18-15(22)11-3-4-11/h7,11H,3-6,8-9H2,1-2H3,(H,16,23)
InChIKeyNVTOPXAKOXVGRY-UHFFFAOYSA-N
XLogP0.65
TPSA80.87 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide with MolForge

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Related Compounds

N-[2-(4,6-dimethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]-2-pyrrolidin-1-ylacetamide
CID 2332241
N-(3-tert-butyl-1-methylpyrazol-5-yl)-2-(3-ethyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)acetamide
CID 53568458
N-(2,5-dimethylpyrazol-3-yl)-2-[2-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]pyrrolidin-1-yl]acetamide
CID 53571503
N-(2,5-dimethylpyrazol-3-yl)-2-(1-methyl-2-propan-2-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)acetamide
CID 53572102
N-(2,5-dimethylpyrazol-3-yl)-2-[3-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]piperidin-1-yl]acetamide
CID 53609081
N-(2,5-dimethylpyrazol-3-yl)-2-(3-ethyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)acetamide
CID 56780136
N-(2,5-dimethylpyrazol-3-yl)-2-(3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)acetamide
CID 56780153
N-{2-[(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl}acetamide
CID 70778254
2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2-propylpyrazol-3-yl)acetamide
CID 71932634
2-(2-cyclopropyl-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-N-(2-propylpyrazol-3-yl)acetamide
CID 71932717
2-[2-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]-N-(2,5-dimethylpyrazol-3-yl)acetamide
CID 72122849
N-(2,5-dimethylpyrazol-3-yl)-2-[(2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]acetamide
CID 72142326

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide?
The IUPAC name of 2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide (CID 56781632) is 2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide is Cc1cc(NC(=O)CN2CCn3c(nnc3C3CC3)C2)n(C)n1.
What is the InChIKey of 2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide?
The InChIKey is NVTOPXAKOXVGRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N7O/c1-10-7-12(20(2)19-10)16-14(23)9-21-5-6-22-13(8-21)17-18-15(22)11-3-4-11/h7,11H,3-6,8-9H2,1-2H3,(H,16,23).
What are the key properties of 2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide?
2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide has a molecular weight of 315.38 g/mol, XLogP of 0.65, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropyl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-(2,5-dimethylpyrazol-3-yl)acetamide is sourced from PubChem (CID 56781632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).