[5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone

C20H20N6O2 — CID 71802145

IUPAC[5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone
SMILESO=C(c1cc(-c2ccco2)[nH]n1)N1CCN(Cc2cnc3ccccn23)CC1
InChIInChI=1S/C20H20N6O2/c27-20(17-12-16(22-23-17)18-4-3-11-28-18)25-9-7-24(8-10-25)14-15-13-21-19-5-1-2-6-26(15)19/h1-6,11-13H,7-10,14H2,(H,22,23)
InChIKeyUBQFHGXTWQDPQJ-UHFFFAOYSA-N
MW376.42 g/mol
LogP2.28
Rot. Bonds4

About [5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone

[5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone (PubChem CID 71802145) has the molecular formula C20H20N6O2 and a molecular weight of 376.42 g/mol. Its IUPAC name is [5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name[5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone
PubChem CID71802145
Molecular FormulaC20H20N6O2
Molecular Weight376.42 g/mol
Exact Mass376.16
IUPAC Name[5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone
SMILESO=C(c1cc(-c2ccco2)[nH]n1)N1CCN(Cc2cnc3ccccn23)CC1
InChIInChI=1S/C20H20N6O2/c27-20(17-12-16(22-23-17)18-4-3-11-28-18)25-9-7-24(8-10-25)14-15-13-21-19-5-1-2-6-26(15)19/h1-6,11-13H,7-10,14H2,(H,22,23)
InChIKeyUBQFHGXTWQDPQJ-UHFFFAOYSA-N
XLogP2.28
TPSA82.67 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone?
The IUPAC name of [5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone (CID 71802145) is [5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone.
What is the SMILES notation for [5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone?
The canonical SMILES for [5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone is O=C(c1cc(-c2ccco2)[nH]n1)N1CCN(Cc2cnc3ccccn23)CC1.
What is the InChIKey of [5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone?
The InChIKey is UBQFHGXTWQDPQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N6O2/c27-20(17-12-16(22-23-17)18-4-3-11-28-18)25-9-7-24(8-10-25)14-15-13-21-19-5-1-2-6-26(15)19/h1-6,11-13H,7-10,14H2,(H,22,23).
What are the key properties of [5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone?
[5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone has a molecular weight of 376.42 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(furan-2-yl)-1H-pyrazol-3-yl]-[4-(imidazo[1,2-a]pyridin-3-ylmethyl)piperazin-1-yl]methanone is sourced from PubChem (CID 71802145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).