N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide

C22H25N3O2 — CID 86899973

IUPACN,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide
SMILESCN(C)C(=O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)cc2ccccc21
InChIInChI=1S/C22H25N3O2/c1-22(2,21(27)24(3)4)23-20(26)15-25-18-13-9-8-12-17(18)14-19(25)16-10-6-5-7-11-16/h5-14H,15H2,1-4H3,(H,23,26)
InChIKeyPWXGMIJVTGRLRV-UHFFFAOYSA-N
MW363.46 g/mol
LogP3.29
Rot. Bonds5

About N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide

N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide (PubChem CID 86899973) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide.

Molecular Properties

Compound NameN,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide
PubChem CID86899973
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC NameN,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide
SMILESCN(C)C(=O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)cc2ccccc21
InChIInChI=1S/C22H25N3O2/c1-22(2,21(27)24(3)4)23-20(26)15-25-18-13-9-8-12-17(18)14-19(25)16-10-6-5-7-11-16/h5-14H,15H2,1-4H3,(H,23,26)
InChIKeyPWXGMIJVTGRLRV-UHFFFAOYSA-N
XLogP3.29
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4,5-dihydro-1,3-thiazol-2-yl)-2-(2-phenylindol-1-yl)acetamide
CID 8832224
2-(2-phenylindol-1-yl)-N-[1-(4-phenylphenyl)propan-2-yl]acetamide
CID 155968281
N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-(2-phenylindol-1-yl)acetamide
CID 16575307
2-methyl-4-[[2-(2-phenylindol-1-yl)acetyl]amino]benzamide
CID 56518035
1-(3-methylbut-3-enyl)-2-phenylindole
CID 114476740
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(2-phenylindol-1-yl)acetamide
CID 47029046
N-methyl-N-(oxolan-3-yl)-2-(2-phenylindol-1-yl)acetamide
CID 86896910
1-pentyl-2-phenylindole
CID 54214068
1-phenyl-3-(2-phenylindol-1-yl)propan-1-one
CID 151018616
2-(2-phenylindol-1-yl)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide
CID 55396627
N-methyl-2-(2-phenylindol-1-yl)-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 134047099
N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(2-phenylindol-1-yl)acetamide
CID 42651779

Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide?
The IUPAC name of N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide (CID 86899973) is N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide.
What is the SMILES notation for N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide?
The canonical SMILES for N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide is CN(C)C(=O)C(C)(C)NC(=O)Cn1c(-c2ccccc2)cc2ccccc21.
What is the InChIKey of N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide?
The InChIKey is PWXGMIJVTGRLRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O2/c1-22(2,21(27)24(3)4)23-20(26)15-25-18-13-9-8-12-17(18)14-19(25)16-10-6-5-7-11-16/h5-14H,15H2,1-4H3,(H,23,26).
What are the key properties of N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide?
N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide has a molecular weight of 363.46 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-2-[[2-(2-phenylindol-1-yl)acetyl]amino]propanamide is sourced from PubChem (CID 86899973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).