1-(2-aminophenyl)-2-methylpropan-1-ol

C10H15NO — CID 64834180

IUPAC1-(2-aminophenyl)-2-methylpropan-1-ol
SMILESCC(C)C(O)c1ccccc1N
InChIInChI=1S/C10H15NO/c1-7(2)10(12)8-5-3-4-6-9(8)11/h3-7,10,12H,11H2,1-2H3
InChIKeyWBTAGTVNDPLRSJ-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.96
Rot. Bonds2

About 1-(2-aminophenyl)-2-methylpropan-1-ol

1-(2-aminophenyl)-2-methylpropan-1-ol (PubChem CID 64834180) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 1-(2-aminophenyl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name1-(2-aminophenyl)-2-methylpropan-1-ol
PubChem CID64834180
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name1-(2-aminophenyl)-2-methylpropan-1-ol
SMILESCC(C)C(O)c1ccccc1N
InChIInChI=1S/C10H15NO/c1-7(2)10(12)8-5-3-4-6-9(8)11/h3-7,10,12H,11H2,1-2H3
InChIKeyWBTAGTVNDPLRSJ-UHFFFAOYSA-N
XLogP1.96
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(1S,2S)-1,2-bis(2-aminophenyl)ethane-1,2-diol
CID 166060261
(1S,2S)-1-(2-aminophenyl)propane-1,2-diol
CID 54485712
(1S)-1-(2-aminophenyl)ethanol
CID 12749796
(2S,3S)-3-(2-aminophenyl)butan-2-ol
CID 131028904
(1S,2R)-2-(2-aminophenyl)-1-phenylpropan-1-ol
CID 23726159
1-(2-aminophenyl)-1-iodo-3-methylbutan-2-ol
CID 129174808
3-amino-4-(1-hydroxy-2-methylpropyl)phenol
CID 105439440
2-methyl-1-(2-methylsulfanylphenyl)propan-1-ol
CID 115840237
N-[1-(2-aminophenyl)ethyl]-2-methylpropanamide
CID 43297755
2-(1-aminoethyl)aniline;sulfuric acid
CID 67830169
1-(2-amino-5-methoxyphenyl)-2-methylpropan-1-ol
CID 105449197
1-(2-aminophenyl)-3-methylpentan-1-ol
CID 64832579

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminophenyl)-2-methylpropan-1-ol?
The IUPAC name of 1-(2-aminophenyl)-2-methylpropan-1-ol (CID 64834180) is 1-(2-aminophenyl)-2-methylpropan-1-ol.
What is the SMILES notation for 1-(2-aminophenyl)-2-methylpropan-1-ol?
The canonical SMILES for 1-(2-aminophenyl)-2-methylpropan-1-ol is CC(C)C(O)c1ccccc1N.
What is the InChIKey of 1-(2-aminophenyl)-2-methylpropan-1-ol?
The InChIKey is WBTAGTVNDPLRSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-7(2)10(12)8-5-3-4-6-9(8)11/h3-7,10,12H,11H2,1-2H3.
What are the key properties of 1-(2-aminophenyl)-2-methylpropan-1-ol?
1-(2-aminophenyl)-2-methylpropan-1-ol has a molecular weight of 165.24 g/mol, XLogP of 1.96, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminophenyl)-2-methylpropan-1-ol is sourced from PubChem (CID 64834180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).