N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide

C15H22N2O2 — CID 113058073

IUPACN-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide
SMILESCCC(=O)NCCN(C(C)=O)c1c(C)cccc1C
InChIInChI=1S/C15H22N2O2/c1-5-14(19)16-9-10-17(13(4)18)15-11(2)7-6-8-12(15)3/h6-8H,5,9-10H2,1-4H3,(H,16,19)
InChIKeyZRQYBLGHZOBZOL-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.18
Rot. Bonds5

About N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide

N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide (PubChem CID 113058073) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide.

Molecular Properties

Compound NameN-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide
PubChem CID113058073
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide
SMILESCCC(=O)NCCN(C(C)=O)c1c(C)cccc1C
InChIInChI=1S/C15H22N2O2/c1-5-14(19)16-9-10-17(13(4)18)15-11(2)7-6-8-12(15)3/h6-8H,5,9-10H2,1-4H3,(H,16,19)
InChIKeyZRQYBLGHZOBZOL-UHFFFAOYSA-N
XLogP2.18
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]cyclopropanecarboxamide
CID 113058076
N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-(2-methylphenyl)acetamide
CID 113058904
N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]-3-phenoxypropanamide
CID 113058113
3-(N-acetyl-2,6-dimethylanilino)-N-[3-(dimethylamino)propyl]propanamide
CID 113124825
N-[2-(N-acetyl-2-ethyl-6-methylanilino)ethyl]-4-methylbenzamide
CID 113058508
N-[2-[N-acetyl-2,6-di(propan-2-yl)anilino]ethyl]-2-(2-methylphenyl)acetamide
CID 113063126
3-(N-acetyl-2-ethyl-6-methylanilino)-N-(2-methoxyethyl)propanamide
CID 113125511
3-(N-acetyl-2-methyl-6-propan-2-ylanilino)-N-[2-(dimethylamino)ethyl]propanamide
CID 113126259
3-(N-acetyl-2,6-dimethylanilino)-N-[(2-methylphenyl)methyl]propanamide
CID 113124832
N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-(3-methylphenyl)acetamide
CID 113058905
2-(N-acetyl-2,6-dimethylanilino)-N-prop-2-enylacetamide
CID 113168626
N-(2,6-dimethylphenyl)-N-[2-(2-phenylethylsulfonylamino)ethyl]acetamide
CID 113058169

Frequently Asked Questions

What is the IUPAC name of N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide?
The IUPAC name of N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide (CID 113058073) is N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide.
What is the SMILES notation for N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide?
The canonical SMILES for N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide is CCC(=O)NCCN(C(C)=O)c1c(C)cccc1C.
What is the InChIKey of N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide?
The InChIKey is ZRQYBLGHZOBZOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-5-14(19)16-9-10-17(13(4)18)15-11(2)7-6-8-12(15)3/h6-8H,5,9-10H2,1-4H3,(H,16,19).
What are the key properties of N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide?
N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide has a molecular weight of 262.35 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(N-acetyl-2,6-dimethylanilino)ethyl]propanamide is sourced from PubChem (CID 113058073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).