N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide

C22H26N2O — CID 113085688

IUPACN-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide
SMILESCc1[nH]c2ccccc2c1C(C)(C)CNC(=O)CCc1ccccc1
InChIInChI=1S/C22H26N2O/c1-16-21(18-11-7-8-12-19(18)24-16)22(2,3)15-23-20(25)14-13-17-9-5-4-6-10-17/h4-12,24H,13-15H2,1-3H3,(H,23,25)
InChIKeyZLOODRAXZWBLCZ-UHFFFAOYSA-N
MW334.46 g/mol
LogP4.50
Rot. Bonds6

About N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide

N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide (PubChem CID 113085688) has the molecular formula C22H26N2O and a molecular weight of 334.46 g/mol. Its IUPAC name is N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide
PubChem CID113085688
Molecular FormulaC22H26N2O
Molecular Weight334.46 g/mol
Exact Mass334.20
IUPAC NameN-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide
SMILESCc1[nH]c2ccccc2c1C(C)(C)CNC(=O)CCc1ccccc1
InChIInChI=1S/C22H26N2O/c1-16-21(18-11-7-8-12-19(18)24-16)22(2,3)15-23-20(25)14-13-17-9-5-4-6-10-17/h4-12,24H,13-15H2,1-3H3,(H,23,25)
InChIKeyZLOODRAXZWBLCZ-UHFFFAOYSA-N
XLogP4.50
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-2-phenylacetamide
CID 113085684
2-(4-chlorophenyl)-N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]acetamide
CID 113085686
2-(3-fluorophenyl)-N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]acetamide
CID 113085706
2-methyl-2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)propanamide
CID 113211551
4-bromo-N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]benzamide
CID 113085673
N-(2,2-dimethylpropyl)-3-phenylpropanamide
CID 100801997
N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]benzenesulfonamide
CID 113085726
3-methoxy-N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]benzamide
CID 113085675
N-(3-chloro-2,2-dimethylpropyl)-3-phenylpropanamide
CID 115364651
N-[(E)-(2-methyl-1H-indol-3-yl)methylideneamino]-3-phenylpropanamide
CID 135420145
2-[[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]amino]acetonitrile
CID 115131519
2-(2-methyl-1H-indol-3-yl)-N-(2-phenylethyl)acetamide
CID 31852687

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide?
The IUPAC name of N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide (CID 113085688) is N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide.
What is the SMILES notation for N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide?
The canonical SMILES for N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide is Cc1[nH]c2ccccc2c1C(C)(C)CNC(=O)CCc1ccccc1.
What is the InChIKey of N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide?
The InChIKey is ZLOODRAXZWBLCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O/c1-16-21(18-11-7-8-12-19(18)24-16)22(2,3)15-23-20(25)14-13-17-9-5-4-6-10-17/h4-12,24H,13-15H2,1-3H3,(H,23,25).
What are the key properties of N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide?
N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide has a molecular weight of 334.46 g/mol, XLogP of 4.50, 6 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-2-(2-methyl-1H-indol-3-yl)propyl]-3-phenylpropanamide is sourced from PubChem (CID 113085688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).