2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide

C20H19NO3 — CID 46820829

IUPAC2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide
SMILESCOc1cc2c(cc1NC(=O)CC1C=CCC1)oc1ccccc12
InChIInChI=1S/C20H19NO3/c1-23-19-11-15-14-8-4-5-9-17(14)24-18(15)12-16(19)21-20(22)10-13-6-2-3-7-13/h2,4-6,8-9,11-13H,3,7,10H2,1H3,(H,21,22)
InChIKeyPHBTXNZJNJWSEI-UHFFFAOYSA-N
MW321.38 g/mol
LogP4.89
Rot. Bonds4

About 2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide

2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide (PubChem CID 46820829) has the molecular formula C20H19NO3 and a molecular weight of 321.38 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide
PubChem CID46820829
Molecular FormulaC20H19NO3
Molecular Weight321.38 g/mol
Exact Mass321.14
IUPAC Name2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide
SMILESCOc1cc2c(cc1NC(=O)CC1C=CCC1)oc1ccccc12
InChIInChI=1S/C20H19NO3/c1-23-19-11-15-14-8-4-5-9-17(14)24-18(15)12-16(19)21-20(22)10-13-6-2-3-7-13/h2,4-6,8-9,11-13H,3,7,10H2,1H3,(H,21,22)
InChIKeyPHBTXNZJNJWSEI-UHFFFAOYSA-N
XLogP4.89
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl] cyclopropanecarboxylate
CID 2510908
2-cyclopent-2-en-1-yl-N-(2,5-dimethoxyphenyl)acetamide
CID 18196579
N-(2-methoxydibenzofuran-3-yl)-2-(4-methylpiperidin-1-yl)acetamide
CID 2419747
N-(2-methoxydibenzofuran-3-yl)-3,3-diphenylpropanamide
CID 2935191
tert-butyl 4-[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl]piperidine-1-carboxylate
CID 52775307
N-(2-methoxydibenzofuran-3-yl)-2-piperidin-1-ylacetamide
CID 2697422
N-(5-chloro-2-methoxyphenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide
CID 9068771
4-(2,5-dioxopyrrolidin-1-yl)-N-(2-methoxydibenzofuran-3-yl)butanamide
CID 2219830
2-[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl]sulfanylacetic acid
CID 2401504
2-[[2-[(2-methoxydibenzofuran-3-yl)amino]-2-oxoethyl]-methylamino]-N-methylacetamide
CID 78826575
2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxydibenzofuran-3-yl)acetamide
CID 9347450
2-(1-adamantyl)-N-(2-methoxydibenzofuran-3-yl)acetamide
CID 5144773

Frequently Asked Questions

What is the IUPAC name of 2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide?
The IUPAC name of 2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide (CID 46820829) is 2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide?
The canonical SMILES for 2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide is COc1cc2c(cc1NC(=O)CC1C=CCC1)oc1ccccc12.
What is the InChIKey of 2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide?
The InChIKey is PHBTXNZJNJWSEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO3/c1-23-19-11-15-14-8-4-5-9-17(14)24-18(15)12-16(19)21-20(22)10-13-6-2-3-7-13/h2,4-6,8-9,11-13H,3,7,10H2,1H3,(H,21,22).
What are the key properties of 2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide?
2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide has a molecular weight of 321.38 g/mol, XLogP of 4.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-N-(2-methoxydibenzofuran-3-yl)acetamide is sourced from PubChem (CID 46820829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).