2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide

C11H16N2O2 — CID 43498574

IUPAC2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide
SMILESCC(CO)NC(=O)Cc1ccccc1N
InChIInChI=1S/C11H16N2O2/c1-8(7-14)13-11(15)6-9-4-2-3-5-10(9)12/h2-5,8,14H,6-7,12H2,1H3,(H,13,15)
InChIKeyIHHWTJPUMXQPNJ-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.31
Rot. Bonds4

About 2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide

2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide (PubChem CID 43498574) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide
PubChem CID43498574
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide
SMILESCC(CO)NC(=O)Cc1ccccc1N
InChIInChI=1S/C11H16N2O2/c1-8(7-14)13-11(15)6-9-4-2-3-5-10(9)12/h2-5,8,14H,6-7,12H2,1H3,(H,13,15)
InChIKeyIHHWTJPUMXQPNJ-UHFFFAOYSA-N
XLogP0.31
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-[[2-(2-aminophenyl)acetyl]amino]-3-methylbutanamide
CID 113315006
2-[(2-aminophenyl)methylamino]propan-1-ol
CID 66386252
2-[[2-(2-aminophenyl)acetyl]amino]-N-ethylpropanamide
CID 43574376
N-(1-hydroxypropan-2-yl)-2-(2-nitrophenyl)acetamide
CID 43418816
2-(2-aminophenyl)-N-[1-(4-methylphenyl)ethyl]acetamide
CID 61102579
3-[[2-(2-aminophenyl)acetyl]amino]-N-butan-2-ylpropanamide
CID 61140780
2-(2-aminophenyl)-N-methylacetamide
CID 16772909
2-(2-aminophenyl)-N-[1-(4-bromophenyl)ethyl]acetamide
CID 61118326
3-(2-aminophenyl)-N-(5-hydroxypentan-2-yl)propanamide
CID 107273243
2-(2-aminophenyl)-N-[1-(5-methylfuran-2-yl)ethyl]acetamide
CID 61138769
2-(2-aminophenyl)-N-(2-methylsulfinylpropyl)acetamide
CID 115976838
[2-(1-methoxypropan-2-ylamino)-2-oxoethyl] 2-(2-aminophenyl)acetate
CID 61487898

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide?
The IUPAC name of 2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide (CID 43498574) is 2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide is CC(CO)NC(=O)Cc1ccccc1N.
What is the InChIKey of 2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide?
The InChIKey is IHHWTJPUMXQPNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-8(7-14)13-11(15)6-9-4-2-3-5-10(9)12/h2-5,8,14H,6-7,12H2,1H3,(H,13,15).
What are the key properties of 2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide?
2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide has a molecular weight of 208.26 g/mol, XLogP of 0.31, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-(1-hydroxypropan-2-yl)acetamide is sourced from PubChem (CID 43498574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).