3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide

C18H26N2O — CID 42951930

IUPAC3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide
SMILESCC(C)CC(C)N(C)C(=O)CCc1c[nH]c2ccccc12
InChIInChI=1S/C18H26N2O/c1-13(2)11-14(3)20(4)18(21)10-9-15-12-19-17-8-6-5-7-16(15)17/h5-8,12-14,19H,9-11H2,1-4H3
InChIKeyFKCWQWKANODGJF-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.99
Rot. Bonds6

About 3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide

3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide (PubChem CID 42951930) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is 3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide.

Molecular Properties

Compound Name3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide
PubChem CID42951930
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide
SMILESCC(C)CC(C)N(C)C(=O)CCc1c[nH]c2ccccc12
InChIInChI=1S/C18H26N2O/c1-13(2)11-14(3)20(4)18(21)10-9-15-12-19-17-8-6-5-7-16(15)17/h5-8,12-14,19H,9-11H2,1-4H3
InChIKeyFKCWQWKANODGJF-UHFFFAOYSA-N
XLogP3.99
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(1H-indol-3-yl)-N-[1-(2-methoxyphenyl)ethyl]-N-methylpropanamide
CID 134054534
1-(1H-indol-3-yl)-4-methylpentan-3-one
CID 154964513
N-carbamoyl-3-(1H-indol-3-yl)-N-methylpropanamide
CID 123961243
N-(2-hydroxyethyl)-3-(1H-indol-3-yl)-N-methylpropanamide
CID 60652678
2-(1H-indol-3-yl)-N-methyl-N-(1-methylsulfanylpropan-2-yl)acetamide
CID 112692080
N-(2-amino-2-oxoethyl)-3-(1H-indol-3-yl)-N-propan-2-ylpropanamide
CID 43397899
1-(1H-indol-3-yl)hexan-3-one
CID 166814803
4-(1H-indol-3-yl)butan-2-amine;4-(1H-indol-3-yl)butan-2-one
CID 158100790
N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-(1H-indol-3-yl)propanamide
CID 79380294
3-(1H-indol-3-yl)-N-methyl-N-(2-methylsulfanylethyl)propanamide
CID 112698086
N-[1-[4-(dimethylamino)phenyl]ethyl]-3-(1H-indol-3-yl)propanamide
CID 70160592
3-(1H-indol-3-yl)propanoyloxidanium
CID 142492757

Frequently Asked Questions

What is the IUPAC name of 3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide?
The IUPAC name of 3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide (CID 42951930) is 3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide.
What is the SMILES notation for 3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide?
The canonical SMILES for 3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide is CC(C)CC(C)N(C)C(=O)CCc1c[nH]c2ccccc12.
What is the InChIKey of 3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide?
The InChIKey is FKCWQWKANODGJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-13(2)11-14(3)20(4)18(21)10-9-15-12-19-17-8-6-5-7-16(15)17/h5-8,12-14,19H,9-11H2,1-4H3.
What are the key properties of 3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide?
3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide has a molecular weight of 286.42 g/mol, XLogP of 3.99, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-indol-3-yl)-N-methyl-N-(4-methylpentan-2-yl)propanamide is sourced from PubChem (CID 42951930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).