N-tert-butyl-2-(4-methylindol-1-yl)acetamide

C15H20N2O — CID 116620352

IUPACN-tert-butyl-2-(4-methylindol-1-yl)acetamide
SMILESCc1cccc2c1ccn2CC(=O)NC(C)(C)C
InChIInChI=1S/C15H20N2O/c1-11-6-5-7-13-12(11)8-9-17(13)10-14(18)16-15(2,3)4/h5-9H,10H2,1-4H3,(H,16,18)
InChIKeyCTZUFEFFBLIZNK-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.86
Rot. Bonds2

About N-tert-butyl-2-(4-methylindol-1-yl)acetamide

N-tert-butyl-2-(4-methylindol-1-yl)acetamide (PubChem CID 116620352) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is N-tert-butyl-2-(4-methylindol-1-yl)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(4-methylindol-1-yl)acetamide
PubChem CID116620352
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC NameN-tert-butyl-2-(4-methylindol-1-yl)acetamide
SMILESCc1cccc2c1ccn2CC(=O)NC(C)(C)C
InChIInChI=1S/C15H20N2O/c1-11-6-5-7-13-12(11)8-9-17(13)10-14(18)16-15(2,3)4/h5-9H,10H2,1-4H3,(H,16,18)
InChIKeyCTZUFEFFBLIZNK-UHFFFAOYSA-N
XLogP2.86
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methylindol-1-yl)-N-pentan-3-ylacetamide
CID 116620187
N-tert-butyl-2-indol-1-ylacetamide
CID 47348922
N-(3-methylbutyl)-2-(4-methylindol-1-yl)acetamide
CID 116620292
5-(4-methylindol-1-yl)pentanehydrazide
CID 55214450
2-(3-acetylindol-1-yl)-N-tert-butylacetamide
CID 972491
N-(2-methylbutan-2-yl)-2-(4-nitroindol-1-yl)acetamide
CID 115635433
N-tert-butyl-2-(5,7-dimethyl-4-oxoquinolin-1-yl)acetamide
CID 100744049
2-methyl-4-(4-methylindol-1-yl)butan-2-ol
CID 116620378
2-(4-chloroindol-1-yl)-N-(3-methyl-2-pyridinyl)acetamide
CID 39334901
2-(4-methylindol-1-yl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
CID 53370994
N-tert-butyl-2-[6-(ethylaminomethyl)indol-1-yl]acetamide
CID 102916733
N-tert-butyl-2-[2-(ethylaminomethyl)pyrrol-1-yl]acetamide
CID 66401169

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(4-methylindol-1-yl)acetamide?
The IUPAC name of N-tert-butyl-2-(4-methylindol-1-yl)acetamide (CID 116620352) is N-tert-butyl-2-(4-methylindol-1-yl)acetamide.
What is the SMILES notation for N-tert-butyl-2-(4-methylindol-1-yl)acetamide?
The canonical SMILES for N-tert-butyl-2-(4-methylindol-1-yl)acetamide is Cc1cccc2c1ccn2CC(=O)NC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-(4-methylindol-1-yl)acetamide?
The InChIKey is CTZUFEFFBLIZNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-11-6-5-7-13-12(11)8-9-17(13)10-14(18)16-15(2,3)4/h5-9H,10H2,1-4H3,(H,16,18).
What are the key properties of N-tert-butyl-2-(4-methylindol-1-yl)acetamide?
N-tert-butyl-2-(4-methylindol-1-yl)acetamide has a molecular weight of 244.34 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(4-methylindol-1-yl)acetamide is sourced from PubChem (CID 116620352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).