2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide

C15H23N3O2 — CID 40760037

IUPAC2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide
SMILESCc1cccc(C)c1NC(=O)CN(CC(N)=O)C(C)C
InChIInChI=1S/C15H23N3O2/c1-10(2)18(8-13(16)19)9-14(20)17-15-11(3)6-5-7-12(15)4/h5-7,10H,8-9H2,1-4H3,(H2,16,19)(H,17,20)
InChIKeyOTDMRKPODKDGNB-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.44
Rot. Bonds6

About 2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide

2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide (PubChem CID 40760037) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide.

Molecular Properties

Compound Name2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide
PubChem CID40760037
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide
SMILESCc1cccc(C)c1NC(=O)CN(CC(N)=O)C(C)C
InChIInChI=1S/C15H23N3O2/c1-10(2)18(8-13(16)19)9-14(20)17-15-11(3)6-5-7-12(15)4/h5-7,10H,8-9H2,1-4H3,(H2,16,19)(H,17,20)
InChIKeyOTDMRKPODKDGNB-UHFFFAOYSA-N
XLogP1.44
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(4-bromo-3-methylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide
CID 40760060
2-[[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-propan-2-ylamino]acetamide
CID 47124647
2-[[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]-propan-2-ylamino]acetamide
CID 40760123
N-(2-amino-6-methylphenyl)-2-[butan-2-yl(ethyl)amino]acetamide
CID 43376010
2-[(2-hydroxy-3-methylphenyl)methyl-propan-2-ylamino]acetamide
CID 112553358
N-(2-chloro-6-methylphenyl)-2-[2-(diethylamino)ethyl-propan-2-ylamino]acetamide;hydrochloride
CID 138396786
3-amino-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methylbutanamide;hydrochloride
CID 119683128
bis(2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide);dihydrochloride
CID 69335483
CID 89442401
CID 89442401
N-(2-chloro-6-methylphenyl)-2-[di(propan-2-yl)amino]acetamide;hydrochloride
CID 138402190
2-[[2-[1-(3,4-dimethylphenyl)ethylamino]-2-oxoethyl]-propan-2-ylamino]acetamide
CID 51243480
2-[[2-[1-(2,6-difluorophenyl)propan-2-ylamino]-2-oxoethyl]-propan-2-ylamino]acetamide
CID 56815209

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide?
The IUPAC name of 2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide (CID 40760037) is 2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide.
What is the SMILES notation for 2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide?
The canonical SMILES for 2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide is Cc1cccc(C)c1NC(=O)CN(CC(N)=O)C(C)C.
What is the InChIKey of 2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide?
The InChIKey is OTDMRKPODKDGNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-10(2)18(8-13(16)19)9-14(20)17-15-11(3)6-5-7-12(15)4/h5-7,10H,8-9H2,1-4H3,(H2,16,19)(H,17,20).
What are the key properties of 2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide?
2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide has a molecular weight of 277.37 g/mol, XLogP of 1.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2,6-dimethylanilino)-2-oxoethyl]-propan-2-ylamino]acetamide is sourced from PubChem (CID 40760037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).