(3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone

C18H18N2O2 — CID 3769265

IUPAC(3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone
SMILESCCc1ccc(C(=O)c2oc3nc(C)cc(C)c3c2N)cc1
InChIInChI=1S/C18H18N2O2/c1-4-12-5-7-13(8-6-12)16(21)17-15(19)14-10(2)9-11(3)20-18(14)22-17/h5-9H,4,19H2,1-3H3
InChIKeyFCIKHIRFFGJVGM-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.82
Rot. Bonds3

About (3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone

(3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone (PubChem CID 3769265) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is (3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone.

Molecular Properties

Compound Name(3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone
PubChem CID3769265
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name(3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone
SMILESCCc1ccc(C(=O)c2oc3nc(C)cc(C)c3c2N)cc1
InChIInChI=1S/C18H18N2O2/c1-4-12-5-7-13(8-6-12)16(21)17-15(19)14-10(2)9-11(3)20-18(14)22-17/h5-9H,4,19H2,1-3H3
InChIKeyFCIKHIRFFGJVGM-UHFFFAOYSA-N
XLogP3.82
TPSA69.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone?
The IUPAC name of (3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone (CID 3769265) is (3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone.
What is the SMILES notation for (3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone?
The canonical SMILES for (3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone is CCc1ccc(C(=O)c2oc3nc(C)cc(C)c3c2N)cc1.
What is the InChIKey of (3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone?
The InChIKey is FCIKHIRFFGJVGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-4-12-5-7-13(8-6-12)16(21)17-15(19)14-10(2)9-11(3)20-18(14)22-17/h5-9H,4,19H2,1-3H3.
What are the key properties of (3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone?
(3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone has a molecular weight of 294.35 g/mol, XLogP of 3.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-4,6-dimethylfuro[2,3-b]pyridin-2-yl)-(4-ethylphenyl)methanone is sourced from PubChem (CID 3769265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).