ethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate

C13H16N4O2 — CID 104733396

IUPACethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate
SMILESCCOC(=O)CN(c1nccn2nccc12)C1CC1
InChIInChI=1S/C13H16N4O2/c1-2-19-12(18)9-16(10-3-4-10)13-11-5-6-15-17(11)8-7-14-13/h5-8,10H,2-4,9H2,1H3
InChIKeyZYMLIIHQMVNXID-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.26
Rot. Bonds5

About ethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate

ethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate (PubChem CID 104733396) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is ethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate.

Molecular Properties

Compound Nameethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate
PubChem CID104733396
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Nameethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate
SMILESCCOC(=O)CN(c1nccn2nccc12)C1CC1
InChIInChI=1S/C13H16N4O2/c1-2-19-12(18)9-16(10-3-4-10)13-11-5-6-15-17(11)8-7-14-13/h5-8,10H,2-4,9H2,1H3
InChIKeyZYMLIIHQMVNXID-UHFFFAOYSA-N
XLogP1.26
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl 2-[propyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate
CID 104733386
ethyl 2-[cyclopropyl-(3-nitro-2-pyridinyl)amino]acetate
CID 62006677
ethyl 2-[(5-bromoisoquinolin-1-yl)-cyclopropylamino]acetate
CID 106541932
ethyl 2-[cyclopropyl-(2-oxo-1H-pyrazin-3-yl)amino]acetate
CID 114571207
2-[cyclopentyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]ethanol
CID 104733071
N-cyclopropyl-N-(piperidin-4-ylmethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 104732739
N'-cycloheptyl-N'-pyrazolo[1,5-a]pyrazin-4-ylpropane-1,3-diamine
CID 104729848
ethyl 2-[cyclopropyl-(1-phenyltetrazol-5-yl)amino]acetate
CID 62006681
N-(3-bromopropyl)-N-cyclobutylpyrazolo[1,5-a]pyrazin-4-amine
CID 102871209
ethyl 2-[cyclopropyl-(2-pyrazol-1-ylacetyl)amino]acetate
CID 54984137
methyl 4-[methyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]butanoate
CID 113446558
ethyl 2-[cyclopropyl-[4-(trifluoromethyl)-2-pyridinyl]amino]acetate
CID 66329484

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate?
The IUPAC name of ethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate (CID 104733396) is ethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate.
What is the SMILES notation for ethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate?
The canonical SMILES for ethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate is CCOC(=O)CN(c1nccn2nccc12)C1CC1.
What is the InChIKey of ethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate?
The InChIKey is ZYMLIIHQMVNXID-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-2-19-12(18)9-16(10-3-4-10)13-11-5-6-15-17(11)8-7-14-13/h5-8,10H,2-4,9H2,1H3.
What are the key properties of ethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate?
ethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate has a molecular weight of 260.30 g/mol, XLogP of 1.26, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[cyclopropyl(pyrazolo[1,5-a]pyrazin-4-yl)amino]acetate is sourced from PubChem (CID 104733396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).