N-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide

C14H28N2O2 — CID 58165955

IUPACN-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide
SMILESCC(CC(=O)N(C)CCN(C)C)C(=O)C(C)(C)C
InChIInChI=1S/C14H28N2O2/c1-11(13(18)14(2,3)4)10-12(17)16(7)9-8-15(5)6/h11H,8-10H2,1-7H3
InChIKeyBUXFWJYXGIOPBO-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.65
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide

N-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide (PubChem CID 58165955) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide
PubChem CID58165955
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide
SMILESCC(CC(=O)N(C)CCN(C)C)C(=O)C(C)(C)C
InChIInChI=1S/C14H28N2O2/c1-11(13(18)14(2,3)4)10-12(17)16(7)9-8-15(5)6/h11H,8-10H2,1-7H3
InChIKeyBUXFWJYXGIOPBO-UHFFFAOYSA-N
XLogP1.65
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide (CID 58165955) is N-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide is CC(CC(=O)N(C)CCN(C)C)C(=O)C(C)(C)C.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide?
The InChIKey is BUXFWJYXGIOPBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-11(13(18)14(2,3)4)10-12(17)16(7)9-8-15(5)6/h11H,8-10H2,1-7H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide?
N-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide has a molecular weight of 256.39 g/mol, XLogP of 1.65, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-N,3,5,5-tetramethyl-4-oxohexanamide is sourced from PubChem (CID 58165955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).