2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide

C16H24N2O — CID 79809243

IUPAC2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide
SMILESCCC(N)(CC)C(=O)N(C)C1CCc2ccccc21
InChIInChI=1S/C16H24N2O/c1-4-16(17,5-2)15(19)18(3)14-11-10-12-8-6-7-9-13(12)14/h6-9,14H,4-5,10-11,17H2,1-3H3
InChIKeyGMSLBFAJCUAYGS-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.65
Rot. Bonds4

About 2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide

2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide (PubChem CID 79809243) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide.

Molecular Properties

Compound Name2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide
PubChem CID79809243
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide
SMILESCCC(N)(CC)C(=O)N(C)C1CCc2ccccc21
InChIInChI=1S/C16H24N2O/c1-4-16(17,5-2)15(19)18(3)14-11-10-12-8-6-7-9-13(12)14/h6-9,14H,4-5,10-11,17H2,1-3H3
InChIKeyGMSLBFAJCUAYGS-UHFFFAOYSA-N
XLogP2.65
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide?
The IUPAC name of 2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide (CID 79809243) is 2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide.
What is the SMILES notation for 2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide?
The canonical SMILES for 2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide is CCC(N)(CC)C(=O)N(C)C1CCc2ccccc21.
What is the InChIKey of 2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide?
The InChIKey is GMSLBFAJCUAYGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-4-16(17,5-2)15(19)18(3)14-11-10-12-8-6-7-9-13(12)14/h6-9,14H,4-5,10-11,17H2,1-3H3.
What are the key properties of 2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide?
2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide has a molecular weight of 260.38 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,3-dihydro-1H-inden-1-yl)-2-ethyl-N-methylbutanamide is sourced from PubChem (CID 79809243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).