N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide

C20H22N2O2 — CID 113167631

IUPACN-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide
SMILESCC(=O)N(CC(=O)N1c2ccccc2CC1C)c1cccc(C)c1
InChIInChI=1S/C20H22N2O2/c1-14-7-6-9-18(11-14)21(16(3)23)13-20(24)22-15(2)12-17-8-4-5-10-19(17)22/h4-11,15H,12-13H2,1-3H3
InChIKeySXFZXTFAXHOBDD-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.33
Rot. Bonds3

About N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide

N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide (PubChem CID 113167631) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide
PubChem CID113167631
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC NameN-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide
SMILESCC(=O)N(CC(=O)N1c2ccccc2CC1C)c1cccc(C)c1
InChIInChI=1S/C20H22N2O2/c1-14-7-6-9-18(11-14)21(16(3)23)13-20(24)22-15(2)12-17-8-4-5-10-19(17)22/h4-11,15H,12-13H2,1-3H3
InChIKeySXFZXTFAXHOBDD-UHFFFAOYSA-N
XLogP3.33
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-difluorophenyl)-N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]acetamide
CID 113181536
N-ethyl-2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3-methylphenyl)acetamide
CID 109011137
N-cyclopentyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]acetamide
CID 113159384
N-(3-chloro-4-methylphenyl)-N-[3-(2-methyl-2,3-dihydroindol-1-yl)-3-oxopropyl]acetamide
CID 113128090
N-ethyl-3-(2-methyl-2,3-dihydroindol-1-yl)-N-(3-methylphenyl)propanamide
CID 109042621
N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(2-methylpropyl)acetamide
CID 113158988
3-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide
CID 113001074
N-[4-(dimethylamino)phenyl]-N-[3-(2-methyl-2,3-dihydroindol-1-yl)-3-oxopropyl]acetamide
CID 113131813
2-methoxy-5-methyl-N-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]-N-phenylbenzenesulfonamide
CID 100795964
1,2-bis(2-methyl-2,3-dihydroindol-1-yl)ethanone
CID 73142226
2-[methyl-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl]amino]-N-(4-methylphenyl)acetamide
CID 8729209
N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(oxolan-2-ylmethyl)acetamide
CID 113160363

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide?
The IUPAC name of N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide (CID 113167631) is N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide.
What is the SMILES notation for N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide?
The canonical SMILES for N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide is CC(=O)N(CC(=O)N1c2ccccc2CC1C)c1cccc(C)c1.
What is the InChIKey of N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide?
The InChIKey is SXFZXTFAXHOBDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-14-7-6-9-18(11-14)21(16(3)23)13-20(24)22-15(2)12-17-8-4-5-10-19(17)22/h4-11,15H,12-13H2,1-3H3.
What are the key properties of N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide?
N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide has a molecular weight of 322.41 g/mol, XLogP of 3.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]-N-(3-methylphenyl)acetamide is sourced from PubChem (CID 113167631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).