(7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one

C14H17NO2 — CID 134859848

IUPAC(7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one
SMILESO=C1NC/C(=C\C2CCCCC2)c2occc21
InChIInChI=1S/C14H17NO2/c16-14-12-6-7-17-13(12)11(9-15-14)8-10-4-2-1-3-5-10/h6-8,10H,1-5,9H2,(H,15,16)/b11-8+
InChIKeySUYWQVRXKSVQGL-DHZHZOJOSA-N
MW231.29 g/mol
LogP2.99
Rot. Bonds1

About (7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one

(7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one (PubChem CID 134859848) has the molecular formula C14H17NO2 and a molecular weight of 231.29 g/mol. Its IUPAC name is (7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one.

Molecular Properties

Compound Name(7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one
PubChem CID134859848
Molecular FormulaC14H17NO2
Molecular Weight231.29 g/mol
Exact Mass231.13
IUPAC Name(7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one
SMILESO=C1NC/C(=C\C2CCCCC2)c2occc21
InChIInChI=1S/C14H17NO2/c16-14-12-6-7-17-13(12)11(9-15-14)8-10-4-2-1-3-5-10/h6-8,10H,1-5,9H2,(H,15,16)/b11-8+
InChIKeySUYWQVRXKSVQGL-DHZHZOJOSA-N
XLogP2.99
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one?
The IUPAC name of (7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one (CID 134859848) is (7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one.
What is the SMILES notation for (7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one?
The canonical SMILES for (7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one is O=C1NC/C(=C\C2CCCCC2)c2occc21.
What is the InChIKey of (7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one?
The InChIKey is SUYWQVRXKSVQGL-DHZHZOJOSA-N. The full InChI is InChI=1S/C14H17NO2/c16-14-12-6-7-17-13(12)11(9-15-14)8-10-4-2-1-3-5-10/h6-8,10H,1-5,9H2,(H,15,16)/b11-8+.
What are the key properties of (7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one?
(7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one has a molecular weight of 231.29 g/mol, XLogP of 2.99, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7E)-7-(cyclohexylmethylidene)-5,6-dihydrofuro[3,2-c]pyridin-4-one is sourced from PubChem (CID 134859848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).