2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide

C25H30N2O3 — CID 9144751

IUPAC2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
SMILESCc1ccc([C@H](CN2CCOCC2)NC(=O)Cc2coc3c(C)c(C)ccc23)cc1
InChIInChI=1S/C25H30N2O3/c1-17-4-7-20(8-5-17)23(15-27-10-12-29-13-11-27)26-24(28)14-21-16-30-25-19(3)18(2)6-9-22(21)25/h4-9,16,23H,10-15H2,1-3H3,(H,26,28)/t23-/m0/s1
InChIKeyUXVLIZRCSGTTMQ-QHCPKHFHSA-N
MW406.53 g/mol
LogP4.09
Rot. Bonds6

About 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide

2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide (PubChem CID 9144751) has the molecular formula C25H30N2O3 and a molecular weight of 406.53 g/mol. Its IUPAC name is 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide.

Molecular Properties

Compound Name2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
PubChem CID9144751
Molecular FormulaC25H30N2O3
Molecular Weight406.53 g/mol
Exact Mass406.23
IUPAC Name2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
SMILESCc1ccc([C@H](CN2CCOCC2)NC(=O)Cc2coc3c(C)c(C)ccc23)cc1
InChIInChI=1S/C25H30N2O3/c1-17-4-7-20(8-5-17)23(15-27-10-12-29-13-11-27)26-24(28)14-21-16-30-25-19(3)18(2)6-9-22(21)25/h4-9,16,23H,10-15H2,1-3H3,(H,26,28)/t23-/m0/s1
InChIKeyUXVLIZRCSGTTMQ-QHCPKHFHSA-N
XLogP4.09
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.53
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide with MolForge

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Related Compounds

N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-2-thiophen-2-ylacetamide
CID 51925350
2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 9481437
2-(3,4-dimethylphenoxy)-N-[1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 24505048
2-(1,2-benzoxazol-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 9144929
2-(2,6-dimethylphenoxy)-N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 9144717
2-(6,7-dimethyl-1-benzofuran-3-yl)-N-propan-2-ylacetamide
CID 1285216
3,4-dimethyl-N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 9144477
2-(4-methoxyphenoxy)-N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 9144531
2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(2S)-3-methylbutan-2-yl]acetamide
CID 27511094
2-(2-cyclobutyl-4-methyl-1,3-thiazol-5-yl)-N-[1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 146099290
2-benzo[e][1]benzofuran-1-yl-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]acetamide
CID 9149456
2-(4-methylphenyl)sulfanyl-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]acetamide
CID 9149582

Frequently Asked Questions

What is the IUPAC name of 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide?
The IUPAC name of 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide (CID 9144751) is 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide.
What is the SMILES notation for 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide?
The canonical SMILES for 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide is Cc1ccc([C@H](CN2CCOCC2)NC(=O)Cc2coc3c(C)c(C)ccc23)cc1.
What is the InChIKey of 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide?
The InChIKey is UXVLIZRCSGTTMQ-QHCPKHFHSA-N. The full InChI is InChI=1S/C25H30N2O3/c1-17-4-7-20(8-5-17)23(15-27-10-12-29-13-11-27)26-24(28)14-21-16-30-25-19(3)18(2)6-9-22(21)25/h4-9,16,23H,10-15H2,1-3H3,(H,26,28)/t23-/m0/s1.
What are the key properties of 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide?
2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide has a molecular weight of 406.53 g/mol, XLogP of 4.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,7-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide is sourced from PubChem (CID 9144751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).