2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone

C20H24N2O3 — CID 120796270

IUPAC2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone
SMILESNC(C(=O)N1CCc2cc(-c3ccccc3)oc2C1)C1CCOCC1
InChIInChI=1S/C20H24N2O3/c21-19(15-7-10-24-11-8-15)20(23)22-9-6-16-12-17(25-18(16)13-22)14-4-2-1-3-5-14/h1-5,12,15,19H,6-11,13,21H2
InChIKeyFGVBSASKUUFFPX-UHFFFAOYSA-N
MW340.42 g/mol
LogP2.59
Rot. Bonds3

About 2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone

2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone (PubChem CID 120796270) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone.

Molecular Properties

Compound Name2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone
PubChem CID120796270
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone
SMILESNC(C(=O)N1CCc2cc(-c3ccccc3)oc2C1)C1CCOCC1
InChIInChI=1S/C20H24N2O3/c21-19(15-7-10-24-11-8-15)20(23)22-9-6-16-12-17(25-18(16)13-22)14-4-2-1-3-5-14/h1-5,12,15,19H,6-11,13,21H2
InChIKeyFGVBSASKUUFFPX-UHFFFAOYSA-N
XLogP2.59
TPSA68.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone?
The IUPAC name of 2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone (CID 120796270) is 2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone.
What is the SMILES notation for 2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone?
The canonical SMILES for 2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone is NC(C(=O)N1CCc2cc(-c3ccccc3)oc2C1)C1CCOCC1.
What is the InChIKey of 2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone?
The InChIKey is FGVBSASKUUFFPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c21-19(15-7-10-24-11-8-15)20(23)22-9-6-16-12-17(25-18(16)13-22)14-4-2-1-3-5-14/h1-5,12,15,19H,6-11,13,21H2.
What are the key properties of 2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone?
2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone has a molecular weight of 340.42 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(oxan-4-yl)-1-(2-phenyl-5,7-dihydro-4H-furo[2,3-c]pyridin-6-yl)ethanone is sourced from PubChem (CID 120796270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).