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

C18H15N3O2 — CID 858019

IUPAC4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol
SMILESOc1ccc(-c2nc3ccccn3c2NCc2ccco2)cc1
InChIInChI=1S/C18H15N3O2/c22-14-8-6-13(7-9-14)17-18(19-12-15-4-3-11-23-15)21-10-2-1-5-16(21)20-17/h1-11,19,22H,12H2
InChIKeyDDHZYEQOWQQBDS-UHFFFAOYSA-N
MW305.34 g/mol
LogP3.91
Rot. Bonds4

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

4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol (PubChem CID 858019) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is 4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol.

Molecular Properties

Compound Name4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol
PubChem CID858019
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC Name4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol
SMILESOc1ccc(-c2nc3ccccn3c2NCc2ccco2)cc1
InChIInChI=1S/C18H15N3O2/c22-14-8-6-13(7-9-14)17-18(19-12-15-4-3-11-23-15)21-10-2-1-5-16(21)20-17/h1-11,19,22H,12H2
InChIKeyDDHZYEQOWQQBDS-UHFFFAOYSA-N
XLogP3.91
TPSA62.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol?
The IUPAC name of 4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol (CID 858019) is 4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol.
What is the SMILES notation for 4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol?
The canonical SMILES for 4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol is Oc1ccc(-c2nc3ccccn3c2NCc2ccco2)cc1.
What is the InChIKey of 4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol?
The InChIKey is DDHZYEQOWQQBDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c22-14-8-6-13(7-9-14)17-18(19-12-15-4-3-11-23-15)21-10-2-1-5-16(21)20-17/h1-11,19,22H,12H2.
What are the key properties of 4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol?
4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol has a molecular weight of 305.34 g/mol, XLogP of 3.91, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(furan-2-ylmethylamino)imidazo[1,2-a]pyridin-2-yl]phenol is sourced from PubChem (CID 858019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).