2-anilino-2-ethyl-4-methylhexanamide

C15H24N2O — CID 54889196

IUPAC2-anilino-2-ethyl-4-methylhexanamide
SMILESCCC(C)CC(CC)(Nc1ccccc1)C(N)=O
InChIInChI=1S/C15H24N2O/c1-4-12(3)11-15(5-2,14(16)18)17-13-9-7-6-8-10-13/h6-10,12,17H,4-5,11H2,1-3H3,(H2,16,18)
InChIKeyIMTWIRSTIAQRND-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.17
Rot. Bonds7

About 2-anilino-2-ethyl-4-methylhexanamide

2-anilino-2-ethyl-4-methylhexanamide (PubChem CID 54889196) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-anilino-2-ethyl-4-methylhexanamide.

Molecular Properties

Compound Name2-anilino-2-ethyl-4-methylhexanamide
PubChem CID54889196
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-anilino-2-ethyl-4-methylhexanamide
SMILESCCC(C)CC(CC)(Nc1ccccc1)C(N)=O
InChIInChI=1S/C15H24N2O/c1-4-12(3)11-15(5-2,14(16)18)17-13-9-7-6-8-10-13/h6-10,12,17H,4-5,11H2,1-3H3,(H2,16,18)
InChIKeyIMTWIRSTIAQRND-UHFFFAOYSA-N
XLogP3.17
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-4-methyl-2-N-phenylhexane-1,2-diamine
CID 65381513
ethyl 2-anilino-4-methyl-2-(2-methylpropyl)pentanoate
CID 114868091
2-benzyl-2-(4-bromoanilino)butanamide
CID 79008847
methyl 2-ethyl-2-(2-methoxyanilino)-4-methylhexanoate
CID 60993162
methyl 2-ethyl-2-(2-fluoroanilino)-4-methylhexanoate
CID 60993327
2-anilino-3-methyl-2-phenylbutanamide
CID 60996428
2-(4-methylanilino)-2-propylpentanamide
CID 54889215
2-acetamido-2-ethyl-4-methylhexanoic acid
CID 63702394
2-anilino-2-(4-methylphenyl)butanamide
CID 60996158
2-ethylbutyl 2-anilinoacetate
CID 114208440
2,6-dimethyloctane;2,2-dimethyl-N-phenylbutanamide
CID 174845109
2-anilino-2-methyl-3-phenylpropanamide
CID 55151227

Frequently Asked Questions

What is the IUPAC name of 2-anilino-2-ethyl-4-methylhexanamide?
The IUPAC name of 2-anilino-2-ethyl-4-methylhexanamide (CID 54889196) is 2-anilino-2-ethyl-4-methylhexanamide.
What is the SMILES notation for 2-anilino-2-ethyl-4-methylhexanamide?
The canonical SMILES for 2-anilino-2-ethyl-4-methylhexanamide is CCC(C)CC(CC)(Nc1ccccc1)C(N)=O.
What is the InChIKey of 2-anilino-2-ethyl-4-methylhexanamide?
The InChIKey is IMTWIRSTIAQRND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-12(3)11-15(5-2,14(16)18)17-13-9-7-6-8-10-13/h6-10,12,17H,4-5,11H2,1-3H3,(H2,16,18).
What are the key properties of 2-anilino-2-ethyl-4-methylhexanamide?
2-anilino-2-ethyl-4-methylhexanamide has a molecular weight of 248.37 g/mol, XLogP of 3.17, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-2-ethyl-4-methylhexanamide is sourced from PubChem (CID 54889196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).