2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide

C15H22N2O2 — CID 80573453

IUPAC2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide
SMILESCCC(C)(CO)NC(=O)CC1CNc2ccccc21
InChIInChI=1S/C15H22N2O2/c1-3-15(2,10-18)17-14(19)8-11-9-16-13-7-5-4-6-12(11)13/h4-7,11,16,18H,3,8-10H2,1-2H3,(H,17,19)
InChIKeySFHLVHVONZYTKC-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.86
Rot. Bonds5

About 2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide

2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide (PubChem CID 80573453) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide
PubChem CID80573453
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide
SMILESCCC(C)(CO)NC(=O)CC1CNc2ccccc21
InChIInChI=1S/C15H22N2O2/c1-3-15(2,10-18)17-14(19)8-11-9-16-13-7-5-4-6-12(11)13/h4-7,11,16,18H,3,8-10H2,1-2H3,(H,17,19)
InChIKeySFHLVHVONZYTKC-UHFFFAOYSA-N
XLogP1.86
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide (CID 80573453) is 2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide is CCC(C)(CO)NC(=O)CC1CNc2ccccc21.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide?
The InChIKey is SFHLVHVONZYTKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-3-15(2,10-18)17-14(19)8-11-9-16-13-7-5-4-6-12(11)13/h4-7,11,16,18H,3,8-10H2,1-2H3,(H,17,19).
What are the key properties of 2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide?
2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide has a molecular weight of 262.35 g/mol, XLogP of 1.86, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-3-yl)-N-(1-hydroxy-2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 80573453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).