[4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone

C18H19N5O2 — CID 165434167

IUPAC[4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCN(c2nccn3nc(C4CC4)cc23)CC1
InChIInChI=1S/C18H19N5O2/c24-18(16-2-1-11-25-16)22-9-7-21(8-10-22)17-15-12-14(13-3-4-13)20-23(15)6-5-19-17/h1-2,5-6,11-13H,3-4,7-10H2
InChIKeyFUQBRZHUNFUVSG-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.16
Rot. Bonds3

About [4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone

[4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone (PubChem CID 165434167) has the molecular formula C18H19N5O2 and a molecular weight of 337.38 g/mol. Its IUPAC name is [4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone.

Molecular Properties

Compound Name[4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone
PubChem CID165434167
Molecular FormulaC18H19N5O2
Molecular Weight337.38 g/mol
Exact Mass337.15
IUPAC Name[4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCN(c2nccn3nc(C4CC4)cc23)CC1
InChIInChI=1S/C18H19N5O2/c24-18(16-2-1-11-25-16)22-9-7-21(8-10-22)17-15-12-14(13-3-4-13)20-23(15)6-5-19-17/h1-2,5-6,11-13H,3-4,7-10H2
InChIKeyFUQBRZHUNFUVSG-UHFFFAOYSA-N
XLogP2.16
TPSA66.88 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone?
The IUPAC name of [4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone (CID 165434167) is [4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone.
What is the SMILES notation for [4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone?
The canonical SMILES for [4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone is O=C(c1ccco1)N1CCN(c2nccn3nc(C4CC4)cc23)CC1.
What is the InChIKey of [4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone?
The InChIKey is FUQBRZHUNFUVSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O2/c24-18(16-2-1-11-25-16)22-9-7-21(8-10-22)17-15-12-14(13-3-4-13)20-23(15)6-5-19-17/h1-2,5-6,11-13H,3-4,7-10H2.
What are the key properties of [4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone?
[4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone has a molecular weight of 337.38 g/mol, XLogP of 2.16, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-cyclopropylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone is sourced from PubChem (CID 165434167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).