4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide

C16H16N2O3 — CID 42790782

IUPAC4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide
SMILESC/C=C\Cn1c(C(=O)NCc2ccco2)cc2occc21
InChIInChI=1S/C16H16N2O3/c1-2-3-7-18-13-6-9-21-15(13)10-14(18)16(19)17-11-12-5-4-8-20-12/h2-6,8-10H,7,11H2,1H3,(H,17,19)/b3-2-
InChIKeyJFDXJQOVUBOWLC-IHWYPQMZSA-N
MW284.31 g/mol
LogP3.33
Rot. Bonds5

About 4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide

4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide (PubChem CID 42790782) has the molecular formula C16H16N2O3 and a molecular weight of 284.31 g/mol. Its IUPAC name is 4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide.

Molecular Properties

Compound Name4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide
PubChem CID42790782
Molecular FormulaC16H16N2O3
Molecular Weight284.31 g/mol
Exact Mass284.12
IUPAC Name4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide
SMILESC/C=C\Cn1c(C(=O)NCc2ccco2)cc2occc21
InChIInChI=1S/C16H16N2O3/c1-2-3-7-18-13-6-9-21-15(13)10-14(18)16(19)17-11-12-5-4-8-20-12/h2-6,8-10H,7,11H2,1H3,(H,17,19)/b3-2-
InChIKeyJFDXJQOVUBOWLC-IHWYPQMZSA-N
XLogP3.33
TPSA60.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(furan-2-ylmethyl)-4-propylfuro[3,2-b]pyrrole-5-carboxamide
CID 42791099
N-(furan-2-ylmethyl)-4-(12-methyl-9-oxo-5-oxa-1,10,11-triazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,11-tetraen-10-yl)butanamide
CID 20893626
N,4-dibutylfuro[3,2-b]pyrrole-5-carboxamide
CID 3637931
N-(furan-2-ylmethyl)-1,6-dimethylindole-2-carboxamide
CID 110850455
1-N,3-N-bis(furan-2-ylmethyl)benzene-1,3-dicarboxamide
CID 743261
N-(furan-2-ylmethyl)-2-methylfuran-3-carboxamide
CID 845080
N-(furan-2-ylmethyl)acetamide
CID 2394850
N-(furan-2-ylmethyl)-2,4,5-trimethylbenzamide
CID 95970655
5-bromo-2-chloro-N-(furan-2-ylmethyl)benzamide
CID 896756
N-(furan-2-ylmethyl)-6-[(3-methylphenyl)methyl]thieno[2,3-b]pyrrole-5-carboxamide
CID 42797213
6-[(3-fluorophenyl)methyl]-N-(furan-2-ylmethyl)furo[2,3-b]pyrrole-5-carboxamide
CID 42797139
N-(furan-2-ylmethyl)-2-(5-oxa-1,10,11-triazatricyclo[6.4.0.02,6]dodeca-2(6),3,7,9,11-pentaen-9-ylsulfanyl)acetamide
CID 22552430

Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide?
The IUPAC name of 4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide (CID 42790782) is 4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide.
What is the SMILES notation for 4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide?
The canonical SMILES for 4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide is C/C=C\Cn1c(C(=O)NCc2ccco2)cc2occc21.
What is the InChIKey of 4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide?
The InChIKey is JFDXJQOVUBOWLC-IHWYPQMZSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-2-3-7-18-13-6-9-21-15(13)10-14(18)16(19)17-11-12-5-4-8-20-12/h2-6,8-10H,7,11H2,1H3,(H,17,19)/b3-2-.
What are the key properties of 4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide?
4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide has a molecular weight of 284.31 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-but-2-enyl]-N-(furan-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide is sourced from PubChem (CID 42790782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).