N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide

C28H25NO5 — CID 141231712

IUPACN,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide
SMILESCN(C)C(=O)COc1ccc(C(=O)c2oc3cc4c(cc3c2-c2ccccc2)CCCO4)cc1
InChIInChI=1S/C28H25NO5/c1-29(2)25(30)17-33-21-12-10-19(11-13-21)27(31)28-26(18-7-4-3-5-8-18)22-15-20-9-6-14-32-23(20)16-24(22)34-28/h3-5,7-8,10-13,15-16H,6,9,14,17H2,1-2H3
InChIKeyOKSXMZUDCBARAM-UHFFFAOYSA-N
MW455.51 g/mol
LogP5.12
Rot. Bonds6

About N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide

N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide (PubChem CID 141231712) has the molecular formula C28H25NO5 and a molecular weight of 455.51 g/mol. Its IUPAC name is N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide
PubChem CID141231712
Molecular FormulaC28H25NO5
Molecular Weight455.51 g/mol
Exact Mass455.17
IUPAC NameN,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide
SMILESCN(C)C(=O)COc1ccc(C(=O)c2oc3cc4c(cc3c2-c2ccccc2)CCCO4)cc1
InChIInChI=1S/C28H25NO5/c1-29(2)25(30)17-33-21-12-10-19(11-13-21)27(31)28-26(18-7-4-3-5-8-18)22-15-20-9-6-14-32-23(20)16-24(22)34-28/h3-5,7-8,10-13,15-16H,6,9,14,17H2,1-2H3
InChIKeyOKSXMZUDCBARAM-UHFFFAOYSA-N
XLogP5.12
TPSA68.98 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500455.51
LogP ≤ 55.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide 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

2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N,N-dimethylacetamide
CID 141231672
2-[4-(2-benzoyl-6,7-dihydro-5H-furo[3,2-g]chromen-3-yl)phenoxy]-N-phenylacetamide
CID 141231687
[4-[2-(diethylamino)ethoxy]phenyl]-[3-(4-methoxyphenyl)-6,7-dihydro-5H-furo[3,2-g]chromen-2-yl]methanone
CID 141231720
[4-[2-(diethylamino)ethoxy]phenyl]-(3-phenyl-5H-furo[3,2-g]chromen-2-yl)methanone
CID 89497868
3-(3,4-dihydro-2H-chromen-6-yloxy)-N,N-dimethylpropanamide
CID 141195389
4-(3,4-dihydro-2H-chromen-7-yloxy)-N,N-dimethylbutanamide
CID 141195387
N,N-dimethyl-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 46652492
2-[4-(2-benzoyl-5H-furo[3,2-g]chromen-3-yl)phenoxy]-2-(dimethylamino)acetaldehyde
CID 89497893
(4-chlorophenyl)-[3-[4-(2-morpholin-4-ylethoxy)phenyl]-5H-furo[3,2-g]chromen-2-yl]methanone
CID 89497900
2-[4-[3-methyl-2-(4-methylbenzoyl)-8-phenylfuro[2,3-e][1]benzofuran-7-carbonyl]phenoxy]-1-morpholin-4-ylethanone
CID 141472552
N-(3,4-dihydro-2H-chromen-6-yl)-2-phenoxyacetamide
CID 110726178
3-(3,4-dihydro-2H-chromen-7-yloxy)-N,N-diethylpropanamide
CID 141195353

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide?
The IUPAC name of N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide (CID 141231712) is N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide?
The canonical SMILES for N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide is CN(C)C(=O)COc1ccc(C(=O)c2oc3cc4c(cc3c2-c2ccccc2)CCCO4)cc1.
What is the InChIKey of N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide?
The InChIKey is OKSXMZUDCBARAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H25NO5/c1-29(2)25(30)17-33-21-12-10-19(11-13-21)27(31)28-26(18-7-4-3-5-8-18)22-15-20-9-6-14-32-23(20)16-24(22)34-28/h3-5,7-8,10-13,15-16H,6,9,14,17H2,1-2H3.
What are the key properties of N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide?
N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide has a molecular weight of 455.51 g/mol, XLogP of 5.12, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[4-(3-phenyl-6,7-dihydro-5H-furo[3,2-g]chromene-2-carbonyl)phenoxy]acetamide is sourced from PubChem (CID 141231712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).