N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide

C20H21N3O3 — CID 17419691

IUPACN-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)Cn1c(C)cc2ccccc21
InChIInChI=1S/C20H21N3O3/c1-13-10-15-6-4-5-7-18(15)23(13)12-20(25)22-17-11-16(21-14(2)24)8-9-19(17)26-3/h4-11H,12H2,1-3H3,(H,21,24)(H,22,25)
InChIKeyUWBKKBKBKUOWKR-UHFFFAOYSA-N
MW351.41 g/mol
LogP3.56
Rot. Bonds5

About N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide

N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide (PubChem CID 17419691) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide
PubChem CID17419691
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC NameN-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)Cn1c(C)cc2ccccc21
InChIInChI=1S/C20H21N3O3/c1-13-10-15-6-4-5-7-18(15)23(13)12-20(25)22-17-11-16(21-14(2)24)8-9-19(17)26-3/h4-11H,12H2,1-3H3,(H,21,24)(H,22,25)
InChIKeyUWBKKBKBKUOWKR-UHFFFAOYSA-N
XLogP3.56
TPSA72.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2,5-dimethoxy-4-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]benzamide
CID 26705081
4,5-dimethoxy-N,N-dimethyl-2-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
CID 32513243
N-(5-acetamido-2-methoxyphenyl)-2-(benzotriazol-1-yl)acetamide
CID 17457964
N-(4-bromophenyl)-2-(2-methylindol-1-yl)acetamide
CID 4226117
N-(4-chloro-2-methylphenyl)-2-(2-methylindol-1-yl)acetamide
CID 4150176
N-(5-acetamido-2-methoxyphenyl)-3-chloropropanamide
CID 43236542
N-(5-acetamido-2-methoxyphenyl)-2-(azocan-1-yl)acetamide
CID 8680244
N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119680223
N-(5-acetamido-2-methoxyphenyl)-2-(3-methylanilino)acetamide
CID 51224557
2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
CID 30806248
2-(5-acetamido-2-fluoroanilino)-N-(5-acetamido-2-methoxyphenyl)acetamide
CID 37279177
N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
CID 9342184

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide?
The IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide (CID 17419691) is N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide.
What is the SMILES notation for N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide?
The canonical SMILES for N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide is COc1ccc(NC(C)=O)cc1NC(=O)Cn1c(C)cc2ccccc21.
What is the InChIKey of N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide?
The InChIKey is UWBKKBKBKUOWKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c1-13-10-15-6-4-5-7-18(15)23(13)12-20(25)22-17-11-16(21-14(2)24)8-9-19(17)26-3/h4-11H,12H2,1-3H3,(H,21,24)(H,22,25).
What are the key properties of N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide?
N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide has a molecular weight of 351.41 g/mol, XLogP of 3.56, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide is sourced from PubChem (CID 17419691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).