N-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide

C14H28N2O2 — CID 130266290

IUPACN-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide
SMILESCN(C)C(=O)CNC(=O)C(C)(C)CCC(C)(C)C
InChIInChI=1S/C14H28N2O2/c1-13(2,3)8-9-14(4,5)12(18)15-10-11(17)16(6)7/h8-10H2,1-7H3,(H,15,18)
InChIKeyQUXYFVLKVUSKQU-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.04
Rot. Bonds5

About N-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide

N-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide (PubChem CID 130266290) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide
PubChem CID130266290
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide
SMILESCN(C)C(=O)CNC(=O)C(C)(C)CCC(C)(C)C
InChIInChI=1S/C14H28N2O2/c1-13(2,3)8-9-14(4,5)12(18)15-10-11(17)16(6)7/h8-10H2,1-7H3,(H,15,18)
InChIKeyQUXYFVLKVUSKQU-UHFFFAOYSA-N
XLogP2.04
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide?
The IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide (CID 130266290) is N-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide?
The canonical SMILES for N-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide is CN(C)C(=O)CNC(=O)C(C)(C)CCC(C)(C)C.
What is the InChIKey of N-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide?
The InChIKey is QUXYFVLKVUSKQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-13(2,3)8-9-14(4,5)12(18)15-10-11(17)16(6)7/h8-10H2,1-7H3,(H,15,18).
What are the key properties of N-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide?
N-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide has a molecular weight of 256.39 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-oxoethyl]-2,2,5,5-tetramethylhexanamide is sourced from PubChem (CID 130266290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).