N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide

C16H24N2O — CID 63834008

IUPACN-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide
SMILESCC(CC(=O)Nc1ccc2c(c1)CCN2)C(C)(C)C
InChIInChI=1S/C16H24N2O/c1-11(16(2,3)4)9-15(19)18-13-5-6-14-12(10-13)7-8-17-14/h5-6,10-11,17H,7-9H2,1-4H3,(H,18,19)
InChIKeyWGUFOLWKUGFWNM-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.67
Rot. Bonds3

About N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide

N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide (PubChem CID 63834008) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide
PubChem CID63834008
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide
SMILESCC(CC(=O)Nc1ccc2c(c1)CCN2)C(C)(C)C
InChIInChI=1S/C16H24N2O/c1-11(16(2,3)4)9-15(19)18-13-5-6-14-12(10-13)7-8-17-14/h5-6,10-11,17H,7-9H2,1-4H3,(H,18,19)
InChIKeyWGUFOLWKUGFWNM-UHFFFAOYSA-N
XLogP3.67
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide;hydrochloride
CID 119473758
N-(2,3-dihydro-1H-indol-5-yl)butanamide
CID 63253204
N-(2,3-dihydro-1H-indol-5-yl)-2-methylsulfonylacetamide;hydrochloride
CID 119473829
2-acetamido-N-(2,3-dihydro-1H-indol-5-yl)acetamide
CID 63253037
N-(2,3-dihydro-1H-indol-5-yl)-2-methoxypropanamide
CID 115736922
N-(2,3-dihydro-1H-indol-5-yl)-2-phenylacetamide
CID 63252775
N-(2,3-dihydro-1H-indol-5-yl)-3-methylsulfanylpropanamide;hydrochloride
CID 119473853
2-cyclobutyl-N-(2,3-dihydro-1H-indol-5-yl)acetamide;hydrochloride
CID 119473771
3-(2,3-dihydro-1H-indol-5-yl)-1,1-diethylurea
CID 79161283
N-(2,3-dihydro-1H-indol-5-yl)-2-methyl-2-phenylpropanamide
CID 63253292
N-(2,3-dihydro-1H-indol-5-yl)-2-methyl-2-methylsulfonylpropanamide;hydrochloride
CID 119473761
N-(2,3-dihydro-1H-indol-5-yl)-2-(2,5-dimethylphenyl)acetamide;hydrochloride
CID 119473855

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide?
The IUPAC name of N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide (CID 63834008) is N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide.
What is the SMILES notation for N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide?
The canonical SMILES for N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide is CC(CC(=O)Nc1ccc2c(c1)CCN2)C(C)(C)C.
What is the InChIKey of N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide?
The InChIKey is WGUFOLWKUGFWNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-11(16(2,3)4)9-15(19)18-13-5-6-14-12(10-13)7-8-17-14/h5-6,10-11,17H,7-9H2,1-4H3,(H,18,19).
What are the key properties of N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide?
N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide has a molecular weight of 260.38 g/mol, XLogP of 3.67, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide is sourced from PubChem (CID 63834008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).