2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide

C32H25NO5 — CID 141231687

IUPAC2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide
SMILESO=C(COc1ccc(-c2c(C(=O)c3ccccc3)oc3cc4c(cc23)CCCO4)cc1)Nc1ccccc1
InChIInChI=1S/C32H25NO5/c34-29(33-24-11-5-2-6-12-24)20-37-25-15-13-21(14-16-25)30-26-18-23-10-7-17-36-27(23)19-28(26)38-32(30)31(35)22-8-3-1-4-9-22/h1-6,8-9,11-16,18-19H,7,10,17,20H2,(H,33,34)
InChIKeyXWIDRYRQJIAMEK-UHFFFAOYSA-N
MW503.55 g/mol
LogP6.67
Rot. Bonds7

About 2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide

2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide (PubChem CID 141231687) has the molecular formula C32H25NO5 and a molecular weight of 503.55 g/mol. Its IUPAC name is 2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide.

Molecular Properties

Compound Name2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide
PubChem CID141231687
Molecular FormulaC32H25NO5
Molecular Weight503.55 g/mol
Exact Mass503.17
IUPAC Name2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide
SMILESO=C(COc1ccc(-c2c(C(=O)c3ccccc3)oc3cc4c(cc23)CCCO4)cc1)Nc1ccccc1
InChIInChI=1S/C32H25NO5/c34-29(33-24-11-5-2-6-12-24)20-37-25-15-13-21(14-16-25)30-26-18-23-10-7-17-36-27(23)19-28(26)38-32(30)31(35)22-8-3-1-4-9-22/h1-6,8-9,11-16,18-19H,7,10,17,20H2,(H,33,34)
InChIKeyXWIDRYRQJIAMEK-UHFFFAOYSA-N
XLogP6.67
TPSA77.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500503.55
LogP ≤ 56.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N,N-dimethylacetamide
CID 141231672
N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide
CID 141231712
[4-[2-(diethylamino)ethoxy]phenyl]-[3-(4-methoxyphenyl)-6,7-dihydro-5H-furo[3,2-g]chromen-2-yl]methanone
CID 141231720
N-(3,4-dihydro-2H-chromen-6-yl)-2-phenoxyacetamide
CID 110726178
2-(2-methyl-4-oxo-3-phenylchromen-7-yl)oxy-N-phenylacetamide
CID 7714067
N-(4-benzoylphenyl)-2-(4-methylphenoxy)acetamide
CID 837401
N-(4-anilinophenyl)-2-(4-phenylphenoxy)acetamide
CID 4511463
4-(2-anilino-2-oxoethoxy)-N-phenylbenzamide
CID 10545541
3-[(2-phenoxyacetyl)amino]benzamide
CID 910367
N-[4-(oxolan-2-ylmethoxy)phenyl]-2-phenoxyacetamide
CID 4957890
methyl 4-[[2-(2-methyl-4-oxo-3-phenylchromen-7-yl)oxyacetyl]amino]benzoate
CID 26216445
2-(2-oxo-4-propan-2-ylchromen-7-yl)oxy-N-phenylacetamide
CID 7700509

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide?
The IUPAC name of 2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide (CID 141231687) is 2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide.
What is the SMILES notation for 2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide?
The canonical SMILES for 2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide is O=C(COc1ccc(-c2c(C(=O)c3ccccc3)oc3cc4c(cc23)CCCO4)cc1)Nc1ccccc1.
What is the InChIKey of 2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide?
The InChIKey is XWIDRYRQJIAMEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H25NO5/c34-29(33-24-11-5-2-6-12-24)20-37-25-15-13-21(14-16-25)30-26-18-23-10-7-17-36-27(23)19-28(26)38-32(30)31(35)22-8-3-1-4-9-22/h1-6,8-9,11-16,18-19H,7,10,17,20H2,(H,33,34).
What are the key properties of 2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide?
2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide has a molecular weight of 503.55 g/mol, XLogP of 6.67, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide is sourced from PubChem (CID 141231687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).