N-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide

C13H20N2O2 — CID 64548850

IUPACN-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide
SMILESCCC(C)(CN)NC(=O)Cc1cccc(O)c1
InChIInChI=1S/C13H20N2O2/c1-3-13(2,9-14)15-12(17)8-10-5-4-6-11(16)7-10/h4-7,16H,3,8-9,14H2,1-2H3,(H,15,17)
InChIKeyHVKGUEWGGZQCNK-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.18
Rot. Bonds5

About N-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide

N-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide (PubChem CID 64548850) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide
PubChem CID64548850
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide
SMILESCCC(C)(CN)NC(=O)Cc1cccc(O)c1
InChIInChI=1S/C13H20N2O2/c1-3-13(2,9-14)15-12(17)8-10-5-4-6-11(16)7-10/h4-7,16H,3,8-9,14H2,1-2H3,(H,15,17)
InChIKeyHVKGUEWGGZQCNK-UHFFFAOYSA-N
XLogP1.18
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2-(3-hydroxyphenyl)acetamide
CID 61399885
3-(aminomethyl)-1-(3-hydroxyphenyl)-3-methylpentan-2-one
CID 116610789
2-ethyl-2-[[2-(3-hydroxyphenyl)acetyl]amino]butanoic acid
CID 79806517
methyl 2-[[2-(3-hydroxyphenyl)acetyl]amino]-2-methylpentanoate
CID 61399994
N-ethoxy-2-(3-hydroxyphenyl)acetamide
CID 62039263
N-(1-amino-2-methylbutan-2-yl)-2,6-dimethylbenzamide
CID 114026640
N-(1-amino-2-methylbutan-2-yl)-2-hydroxy-3-methylbenzamide
CID 64549061
N-(1-amino-2-methylbutan-2-yl)-2,3-dihydroxybenzamide
CID 114345388
N-(1-amino-3-methylpentan-3-yl)-3-hydroxybenzamide
CID 106164117
2-(2-aminophenyl)-N-(3-methylpentan-3-yl)acetamide
CID 113315023
2-(3-hydroxyphenyl)-N-(1-methoxy-2-phenylpropan-2-yl)acetamide
CID 75518765
N-(1-amino-3-methylpentan-3-yl)-2-(4-methylphenyl)acetamide
CID 114152459

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide?
The IUPAC name of N-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide (CID 64548850) is N-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide?
The canonical SMILES for N-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide is CCC(C)(CN)NC(=O)Cc1cccc(O)c1.
What is the InChIKey of N-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide?
The InChIKey is HVKGUEWGGZQCNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-3-13(2,9-14)15-12(17)8-10-5-4-6-11(16)7-10/h4-7,16H,3,8-9,14H2,1-2H3,(H,15,17).
What are the key properties of N-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide?
N-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide has a molecular weight of 236.31 g/mol, XLogP of 1.18, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylbutan-2-yl)-2-(3-hydroxyphenyl)acetamide is sourced from PubChem (CID 64548850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).