2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol

C17H12Cl2N4O2 — CID 135719573

IUPAC2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol
SMILESOc1c(Cl)cc(-c2nc3cnccn3c2NCc2ccco2)cc1Cl
InChIInChI=1S/C17H12Cl2N4O2/c18-12-6-10(7-13(19)16(12)24)15-17(21-8-11-2-1-5-25-11)23-4-3-20-9-14(23)22-15/h1-7,9,21,24H,8H2
InChIKeyJDZMYUQFKIQENC-UHFFFAOYSA-N
MW375.22 g/mol
LogP4.61
Rot. Bonds4

About 2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol

2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol (PubChem CID 135719573) has the molecular formula C17H12Cl2N4O2 and a molecular weight of 375.22 g/mol. Its IUPAC name is 2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol.

Molecular Properties

Compound Name2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol
PubChem CID135719573
Molecular FormulaC17H12Cl2N4O2
Molecular Weight375.22 g/mol
Exact Mass374.03
IUPAC Name2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol
SMILESOc1c(Cl)cc(-c2nc3cnccn3c2NCc2ccco2)cc1Cl
InChIInChI=1S/C17H12Cl2N4O2/c18-12-6-10(7-13(19)16(12)24)15-17(21-8-11-2-1-5-25-11)23-4-3-20-9-14(23)22-15/h1-7,9,21,24H,8H2
InChIKeyJDZMYUQFKIQENC-UHFFFAOYSA-N
XLogP4.61
TPSA75.59 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.22
LogP ≤ 54.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol?
The IUPAC name of 2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol (CID 135719573) is 2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol.
What is the SMILES notation for 2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol?
The canonical SMILES for 2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol is Oc1c(Cl)cc(-c2nc3cnccn3c2NCc2ccco2)cc1Cl.
What is the InChIKey of 2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol?
The InChIKey is JDZMYUQFKIQENC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2N4O2/c18-12-6-10(7-13(19)16(12)24)15-17(21-8-11-2-1-5-25-11)23-4-3-20-9-14(23)22-15/h1-7,9,21,24H,8H2.
What are the key properties of 2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol?
2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol has a molecular weight of 375.22 g/mol, XLogP of 4.61, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyrazin-2-yl]phenol is sourced from PubChem (CID 135719573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).