2-(2,2-dimethylbutylamino)-N-phenylacetamide

C14H22N2O — CID 113242973

IUPAC2-(2,2-dimethylbutylamino)-N-phenylacetamide
SMILESCCC(C)(C)CNCC(=O)Nc1ccccc1
InChIInChI=1S/C14H22N2O/c1-4-14(2,3)11-15-10-13(17)16-12-8-6-5-7-9-12/h5-9,15H,4,10-11H2,1-3H3,(H,16,17)
InChIKeyODSDMWOZRJIORE-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.65
Rot. Bonds6

About 2-(2,2-dimethylbutylamino)-N-phenylacetamide

2-(2,2-dimethylbutylamino)-N-phenylacetamide (PubChem CID 113242973) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(2,2-dimethylbutylamino)-N-phenylacetamide.

Molecular Properties

Compound Name2-(2,2-dimethylbutylamino)-N-phenylacetamide
PubChem CID113242973
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-(2,2-dimethylbutylamino)-N-phenylacetamide
SMILESCCC(C)(C)CNCC(=O)Nc1ccccc1
InChIInChI=1S/C14H22N2O/c1-4-14(2,3)11-15-10-13(17)16-12-8-6-5-7-9-12/h5-9,15H,4,10-11H2,1-3H3,(H,16,17)
InChIKeyODSDMWOZRJIORE-UHFFFAOYSA-N
XLogP2.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chlorophenyl)-2-(2,2-dimethylbutylamino)acetamide
CID 103698697
2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-phenylacetamide
CID 28572618
N-phenyl-2-(2,2,3-trimethylbutylamino)acetamide
CID 114099870
N-phenyl-2-(2,2,3,3-tetrafluoropropylamino)acetamide
CID 114169332
N-(3-bromophenyl)-2-[(3-hydroxy-2,2-dimethylpropyl)amino]acetamide
CID 113293844
2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(3-methylphenyl)acetamide
CID 28572661
ethyl 3-anilino-3-oxopropanoate
CID 3016808
2-(3,3-dimethylbutan-2-ylamino)-N-phenylacetamide
CID 115626999
2-(benzylamino)-N-(4-tert-butylphenyl)acetamide
CID 108996416
N-(3-bromophenyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
CID 28572652
2-(3,5-dimethylanilino)-N-phenylacetamide
CID 7636819
2-(ethoxyamino)-N-phenylacetamide
CID 60702684

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylbutylamino)-N-phenylacetamide?
The IUPAC name of 2-(2,2-dimethylbutylamino)-N-phenylacetamide (CID 113242973) is 2-(2,2-dimethylbutylamino)-N-phenylacetamide.
What is the SMILES notation for 2-(2,2-dimethylbutylamino)-N-phenylacetamide?
The canonical SMILES for 2-(2,2-dimethylbutylamino)-N-phenylacetamide is CCC(C)(C)CNCC(=O)Nc1ccccc1.
What is the InChIKey of 2-(2,2-dimethylbutylamino)-N-phenylacetamide?
The InChIKey is ODSDMWOZRJIORE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-4-14(2,3)11-15-10-13(17)16-12-8-6-5-7-9-12/h5-9,15H,4,10-11H2,1-3H3,(H,16,17).
What are the key properties of 2-(2,2-dimethylbutylamino)-N-phenylacetamide?
2-(2,2-dimethylbutylamino)-N-phenylacetamide has a molecular weight of 234.34 g/mol, XLogP of 2.65, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylbutylamino)-N-phenylacetamide is sourced from PubChem (CID 113242973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).