N-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide

C16H24N2O2 — CID 110768038

IUPACN-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide
SMILESCC(=O)NCCNC(=O)Cc1c(C)c(C)cc(C)c1C
InChIInChI=1S/C16H24N2O2/c1-10-8-11(2)13(4)15(12(10)3)9-16(20)18-7-6-17-14(5)19/h8H,6-7,9H2,1-5H3,(H,17,19)(H,18,20)
InChIKeyWZSGRPIUUJPVQU-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.72
Rot. Bonds5

About N-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide

N-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide (PubChem CID 110768038) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide.

Molecular Properties

Compound NameN-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide
PubChem CID110768038
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide
SMILESCC(=O)NCCNC(=O)Cc1c(C)c(C)cc(C)c1C
InChIInChI=1S/C16H24N2O2/c1-10-8-11(2)13(4)15(12(10)3)9-16(20)18-7-6-17-14(5)19/h8H,6-7,9H2,1-5H3,(H,17,19)(H,18,20)
InChIKeyWZSGRPIUUJPVQU-UHFFFAOYSA-N
XLogP1.72
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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N-(cyanomethyl)-4-methyl-2-(4-phenylphenyl)pentanamide
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N-(cyanomethyl)-4-methyl-2-{3-[4-(piperidin-4-yl)phenyl]phenyl}pentanamide
CID 18628693
2-(3-methylphenyl)-N-[2-(1-piperidinyl)ethyl]acetamide
CID 6465738
CID 162516977
CID 162516977
N-[2-(Dimethylamino)ethyl]-2,2-diphenylacetamide
CID 422051
N-(2-methylpropyl)-2-phenylacetamide
CID 668859
2-phenyl-N-[4-[(2-phenylacetyl)amino]butyl]acetamide
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N-(2-Aminoethyl)-1-naphthylacetamide hydrochloride
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CID 32995

Frequently Asked Questions

What is the IUPAC name of N-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide?
The IUPAC name of N-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide (CID 110768038) is N-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide.
What is the SMILES notation for N-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide?
The canonical SMILES for N-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide is CC(=O)NCCNC(=O)Cc1c(C)c(C)cc(C)c1C.
What is the InChIKey of N-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide?
The InChIKey is WZSGRPIUUJPVQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-10-8-11(2)13(4)15(12(10)3)9-16(20)18-7-6-17-14(5)19/h8H,6-7,9H2,1-5H3,(H,17,19)(H,18,20).
What are the key properties of N-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide?
N-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide has a molecular weight of 276.38 g/mol, XLogP of 1.72, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamidoethyl)-2-(2,3,5,6-tetramethylphenyl)acetamide is sourced from PubChem (CID 110768038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).