2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide

C16H22N2O — CID 116622911

IUPAC2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)Cn1ccc2cc(C)ccc21
InChIInChI=1S/C16H22N2O/c1-4-5-13(3)17-16(19)11-18-9-8-14-10-12(2)6-7-15(14)18/h6-10,13H,4-5,11H2,1-3H3,(H,17,19)
InChIKeyPXXBZVHBEYZRFZ-UHFFFAOYSA-N
MW258.37 g/mol
LogP3.25
Rot. Bonds5

About 2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide

2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide (PubChem CID 116622911) has the molecular formula C16H22N2O and a molecular weight of 258.37 g/mol. Its IUPAC name is 2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide.

Molecular Properties

Compound Name2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide
PubChem CID116622911
Molecular FormulaC16H22N2O
Molecular Weight258.37 g/mol
Exact Mass258.17
IUPAC Name2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)Cn1ccc2cc(C)ccc21
InChIInChI=1S/C16H22N2O/c1-4-5-13(3)17-16(19)11-18-9-8-14-10-12(2)6-7-15(14)18/h6-10,13H,4-5,11H2,1-3H3,(H,17,19)
InChIKeyPXXBZVHBEYZRFZ-UHFFFAOYSA-N
XLogP3.25
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-(5-methylindol-1-yl)acetamide
CID 116623028
2-(6-aminoindol-1-yl)-N-pentan-2-ylacetamide
CID 61490204
2-(5-methoxyindol-1-yl)-N-(6-methylheptan-2-yl)acetamide
CID 42648833
2-(5-methylindol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 116623041
2-(5-methylindol-1-yl)-N-prop-2-enylacetamide
CID 116623020
2-[7-(aminomethyl)indol-1-yl]-N-pentan-2-ylacetamide
CID 102913404
2-(4-fluoro-3-methylphenyl)-2-[[2-(5-methylindol-1-yl)acetyl]amino]acetic acid
CID 166376773
2-(6-methylindol-1-yl)-N-(2-methyl-4-oxopentan-3-yl)acetamide
CID 62023194
N-(2,5-dimethylphenyl)-2-(5-propan-2-ylindol-1-yl)acetamide
CID 110830986
2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide
CID 100741082
2-(4-methoxyindol-1-yl)-N-pentan-2-ylacetamide
CID 83174347
N-[1-(dimethylamino)propan-2-yl]-2-[6-(4-methylphenyl)indol-1-yl]acetamide
CID 68709137

Frequently Asked Questions

What is the IUPAC name of 2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide?
The IUPAC name of 2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide (CID 116622911) is 2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide.
What is the SMILES notation for 2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide?
The canonical SMILES for 2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide is CCCC(C)NC(=O)Cn1ccc2cc(C)ccc21.
What is the InChIKey of 2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide?
The InChIKey is PXXBZVHBEYZRFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-4-5-13(3)17-16(19)11-18-9-8-14-10-12(2)6-7-15(14)18/h6-10,13H,4-5,11H2,1-3H3,(H,17,19).
What are the key properties of 2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide?
2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide has a molecular weight of 258.37 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylindol-1-yl)-N-pentan-2-ylacetamide is sourced from PubChem (CID 116622911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).