2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide

C14H22N2O2 — CID 106148046

IUPAC2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide
SMILESCC(C)(CCO)CNC(=O)CNc1ccccc1
InChIInChI=1S/C14H22N2O2/c1-14(2,8-9-17)11-16-13(18)10-15-12-6-4-3-5-7-12/h3-7,15,17H,8-11H2,1-2H3,(H,16,18)
InChIKeyAWVHCZDQADIDFT-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.62
Rot. Bonds7

About 2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide

2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide (PubChem CID 106148046) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide.

Molecular Properties

Compound Name2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide
PubChem CID106148046
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide
SMILESCC(C)(CCO)CNC(=O)CNc1ccccc1
InChIInChI=1S/C14H22N2O2/c1-14(2,8-9-17)11-16-13(18)10-15-12-6-4-3-5-7-12/h3-7,15,17H,8-11H2,1-2H3,(H,16,18)
InChIKeyAWVHCZDQADIDFT-UHFFFAOYSA-N
XLogP1.62
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-anilino-N-(5-hydroxy-2,2-dimethylpentyl)acetamide
CID 106148276
2-anilino-N-(2,2,2-trifluoroethyl)acetamide;hydrochloride
CID 119726408
N-(4-hydroxy-2,2-dimethylbutyl)-2-(2-hydroxyphenyl)acetamide
CID 103772553
2-anilino-N-(3-hydroxypropyl)acetamide
CID 60861419
2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide
CID 103825116
4-chloro-N-[2-[(4-hydroxy-2,2-dimethylbutyl)amino]-2-oxoethyl]benzamide
CID 103825506
2-anilino-N-[2-(methylamino)-2-oxoethyl]acetamide
CID 60671281
2-anilino-N-(2-methylpropyl)acetamide
CID 28565172
N-(4-hydroxy-2,2-dimethylbutyl)-2-(3-methylphenyl)acetamide
CID 103772365
N-(4-hydroxy-2,2-dimethylbutyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 113278483
2-anilino-N-(3-methylbut-2-enyl)acetamide
CID 106186880
N-[2-[(4-hydroxy-2,2-dimethylbutyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide
CID 103825297

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide?
The IUPAC name of 2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide (CID 106148046) is 2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide.
What is the SMILES notation for 2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide?
The canonical SMILES for 2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide is CC(C)(CCO)CNC(=O)CNc1ccccc1.
What is the InChIKey of 2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide?
The InChIKey is AWVHCZDQADIDFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-14(2,8-9-17)11-16-13(18)10-15-12-6-4-3-5-7-12/h3-7,15,17H,8-11H2,1-2H3,(H,16,18).
What are the key properties of 2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide?
2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide has a molecular weight of 250.34 g/mol, XLogP of 1.62, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide is sourced from PubChem (CID 106148046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).