2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide

C23H25NO3 — CID 11793080

IUPAC2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide
SMILESCOc1cccc2c1CCC[C@H]2CN(C)C(=O)Cc1ccc2occc2c1
InChIInChI=1S/C23H25NO3/c1-24(23(25)14-16-9-10-21-17(13-16)11-12-27-21)15-18-5-3-7-20-19(18)6-4-8-22(20)26-2/h4,6,8-13,18H,3,5,7,14-15H2,1-2H3/t18-/m0/s1
InChIKeyXIOCFDNSDQPUJK-SFHVURJKSA-N
MW363.46 g/mol
LogP4.56
Rot. Bonds5

About 2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide

2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide (PubChem CID 11793080) has the molecular formula C23H25NO3 and a molecular weight of 363.46 g/mol. Its IUPAC name is 2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide.

Molecular Properties

Compound Name2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide
PubChem CID11793080
Molecular FormulaC23H25NO3
Molecular Weight363.46 g/mol
Exact Mass363.18
IUPAC Name2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide
SMILESCOc1cccc2c1CCC[C@H]2CN(C)C(=O)Cc1ccc2occc2c1
InChIInChI=1S/C23H25NO3/c1-24(23(25)14-16-9-10-21-17(13-16)11-12-27-21)15-18-5-3-7-20-19(18)6-4-8-22(20)26-2/h4,6,8-13,18H,3,5,7,14-15H2,1-2H3/t18-/m0/s1
InChIKeyXIOCFDNSDQPUJK-SFHVURJKSA-N
XLogP4.56
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide 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

6-[2-[(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methyl-methylamino]ethyl]chromen-4-one
CID 19098566
2-(1,3-benzodioxol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-prop-2-ynylacetamide
CID 10620478
2-(1-benzofuran-7-yl)-N-[(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methyl]-N-methylethanamine
CID 67699112
2-isoquinolin-7-yl-N-[(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methyl]-N-methylethanamine
CID 19098384
2-(1,3-benzoxazol-5-yl)-N-[(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methyl]-N-methylethanamine
CID 19098357
N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methyl-2-(2-methyl-1,3-benzoxazol-5-yl)ethanamine
CID 54244474
[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methanol
CID 10535755
2-(2,3-dihydro-1H-inden-5-yl)-N-[(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methyl]-N-methylethanamine;methanesulfonic acid
CID 19098496
6-[2-[(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methyl-methylamino]ethyl]-2H-isoquinolin-1-one
CID 19098446
2-(1H-indazol-6-yl)-N-[(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methyl]-N-methylethanamine
CID 67699375
N-[(2-hydroxycyclohexyl)methyl]-2-(3-methoxy-4-methylphenyl)-N-methylacetamide
CID 110003368
2-(2,3-dihydro-1-benzothiophen-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine;methanesulfonic acid
CID 86747616

Frequently Asked Questions

What is the IUPAC name of 2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide?
The IUPAC name of 2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide (CID 11793080) is 2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide.
What is the SMILES notation for 2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide?
The canonical SMILES for 2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide is COc1cccc2c1CCC[C@H]2CN(C)C(=O)Cc1ccc2occc2c1.
What is the InChIKey of 2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide?
The InChIKey is XIOCFDNSDQPUJK-SFHVURJKSA-N. The full InChI is InChI=1S/C23H25NO3/c1-24(23(25)14-16-9-10-21-17(13-16)11-12-27-21)15-18-5-3-7-20-19(18)6-4-8-22(20)26-2/h4,6,8-13,18H,3,5,7,14-15H2,1-2H3/t18-/m0/s1.
What are the key properties of 2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide?
2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide has a molecular weight of 363.46 g/mol, XLogP of 4.56, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzofuran-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylacetamide is sourced from PubChem (CID 11793080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).