N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide

C16H24N2O2 — CID 112996980

IUPACN-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide
SMILESCCCCC(=O)NCC(=O)Nc1c(C)cccc1CC
InChIInChI=1S/C16H24N2O2/c1-4-6-10-14(19)17-11-15(20)18-16-12(3)8-7-9-13(16)5-2/h7-9H,4-6,10-11H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyAOKIUPILGMRLPA-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.80
Rot. Bonds7

About N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide

N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide (PubChem CID 112996980) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide.

Molecular Properties

Compound NameN-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide
PubChem CID112996980
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide
SMILESCCCCC(=O)NCC(=O)Nc1c(C)cccc1CC
InChIInChI=1S/C16H24N2O2/c1-4-6-10-14(19)17-11-15(20)18-16-12(3)8-7-9-13(16)5-2/h7-9H,4-6,10-11H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyAOKIUPILGMRLPA-UHFFFAOYSA-N
XLogP2.80
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethyl-6-methylphenyl)tetradecanamide
CID 54789893
N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-2-phenylacetamide
CID 112997001
5-(2-ethyl-6-methylanilino)-5-oxopentanoate
CID 4740094
1-butyl-3-(2-ethyl-6-methylphenyl)urea
CID 4278345
N-butyl-3-(2-ethyl-6-methylanilino)propanamide
CID 109012269
N-(2-ethyl-6-methylphenyl)-4-oxopentanamide
CID 11839711
N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]-2-thiophen-2-ylacetamide
CID 112997000
N-(2,6-dimethylphenyl)-2-(2-ethyl-6-methylanilino)acetamide
CID 33004349
N-(2,6-dimethylphenyl)tetradecanamide
CID 54789598
N'-(2-ethyl-6-methylphenyl)butanediamide
CID 82041304
N,N'-bis(2-ethyl-6-methylphenyl)oxamide
CID 3725747
N-(2-ethyl-6-methylphenyl)-2-(propylsulfonylamino)acetamide
CID 112997037

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide?
The IUPAC name of N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide (CID 112996980) is N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide.
What is the SMILES notation for N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide?
The canonical SMILES for N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide is CCCCC(=O)NCC(=O)Nc1c(C)cccc1CC.
What is the InChIKey of N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide?
The InChIKey is AOKIUPILGMRLPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-6-10-14(19)17-11-15(20)18-16-12(3)8-7-9-13(16)5-2/h7-9H,4-6,10-11H2,1-3H3,(H,17,19)(H,18,20).
What are the key properties of N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide?
N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide has a molecular weight of 276.38 g/mol, XLogP of 2.80, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]pentanamide is sourced from PubChem (CID 112996980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).