2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide

C18H25N3O2 — CID 72940380

IUPAC2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide
SMILESCCc1cc(CN(C)C(=O)C(c2ccc(C)cc2)N(C)C)on1
InChIInChI=1S/C18H25N3O2/c1-6-15-11-16(23-19-15)12-21(5)18(22)17(20(3)4)14-9-7-13(2)8-10-14/h7-11,17H,6,12H2,1-5H3
InChIKeyHWEMYVBPGQPDJJ-UHFFFAOYSA-N
MW315.42 g/mol
LogP2.81
Rot. Bonds6

About 2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide

2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide (PubChem CID 72940380) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide
PubChem CID72940380
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC Name2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide
SMILESCCc1cc(CN(C)C(=O)C(c2ccc(C)cc2)N(C)C)on1
InChIInChI=1S/C18H25N3O2/c1-6-15-11-16(23-19-15)12-21(5)18(22)17(20(3)4)14-9-7-13(2)8-10-14/h7-11,17H,6,12H2,1-5H3
InChIKeyHWEMYVBPGQPDJJ-UHFFFAOYSA-N
XLogP2.81
TPSA49.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-(4-chlorophenyl)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-2-hydroxy-N-methylacetamide
CID 95222725
2-(dimethylamino)-N-[(4,6-dimethyl-2-pyridinyl)methyl]-N-methyl-2-(4-methylphenyl)acetamide
CID 72872351
N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)-6-oxo-1H-pyrimidine-5-carboxamide
CID 70718184
(2R)-2-(dimethylamino)-N-[(1-ethylimidazol-2-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide
CID 97191747
N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,5-dimethyl-1H-indazole-3-carboxamide
CID 56703447
3,5-dichloro-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,4-dimethylbenzamide
CID 72893992
2-(3,6-dioxo-1,2-dihydropyridazin-4-yl)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methylacetamide
CID 91787193
N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N,1-dimethylindole-2-carboxamide
CID 56758140
2-(dimethylamino)-2-(3-fluorophenyl)-N-methyl-N-[(3-pyridin-3-yl-1,2-oxazol-5-yl)methyl]acetamide
CID 50971650
N-[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]-2-(dimethylamino)-N-methyl-2-(3-methylphenyl)acetamide
CID 50960712
(2S)-2-(dimethylamino)-2-(4-fluorophenyl)-N-methyl-N-[(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide
CID 96579384
(2S)-2-[(3-ethyl-1,2-oxazol-5-yl)methyl-methylamino]-N-phenylbutanamide
CID 95144078

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide?
The IUPAC name of 2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide (CID 72940380) is 2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide is CCc1cc(CN(C)C(=O)C(c2ccc(C)cc2)N(C)C)on1.
What is the InChIKey of 2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide?
The InChIKey is HWEMYVBPGQPDJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-6-15-11-16(23-19-15)12-21(5)18(22)17(20(3)4)14-9-7-13(2)8-10-14/h7-11,17H,6,12H2,1-5H3.
What are the key properties of 2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide?
2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide has a molecular weight of 315.42 g/mol, XLogP of 2.81, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[(3-ethyl-1,2-oxazol-5-yl)methyl]-N-methyl-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 72940380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).