O-(2-pentan-2-ylphenyl)hydroxylamine

C11H17NO — CID 173492752

IUPACO-(2-pentan-2-ylphenyl)hydroxylamine
SMILESCCCC(C)c1ccccc1ON
InChIInChI=1S/C11H17NO/c1-3-6-9(2)10-7-4-5-8-11(10)13-12/h4-5,7-9H,3,6,12H2,1-2H3
InChIKeyDUBWZFDUTGGCAL-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.84
Rot. Bonds4

About O-(2-pentan-2-ylphenyl)hydroxylamine

O-(2-pentan-2-ylphenyl)hydroxylamine (PubChem CID 173492752) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is O-(2-pentan-2-ylphenyl)hydroxylamine.

Molecular Properties

Compound NameO-(2-pentan-2-ylphenyl)hydroxylamine
PubChem CID173492752
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC NameO-(2-pentan-2-ylphenyl)hydroxylamine
SMILESCCCC(C)c1ccccc1ON
InChIInChI=1S/C11H17NO/c1-3-6-9(2)10-7-4-5-8-11(10)13-12/h4-5,7-9H,3,6,12H2,1-2H3
InChIKeyDUBWZFDUTGGCAL-UHFFFAOYSA-N
XLogP2.84
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

dimethyl-bis(2-pentan-2-ylphenoxy)stannane
CID 67503480
1-methyl-10-pentan-2-ylcyclodeca-1,3,5,7,9-pentaene
CID 123216377
1-ethyl-2-[(2S)-pentan-2-yl]benzene
CID 144927407
1-[(2S,3R)-3-deuteriobutan-2-yl]-2-methoxybenzene
CID 102007298
(2-pentan-2-ylphenyl) N-prop-1-enylcarbamate
CID 71409261
O-(2-ethoxyphenyl)hydroxylamine
CID 70279336
1-(2-ethoxyphenyl)-2-methylpentan-1-amine
CID 115853638
1-methyl-2-(2-pentan-2-ylphenyl)benzene
CID 156706346
CID 174078311
CID 174078311
[2,3-di(pentan-2-yl)phenyl] dihydrogen phosphate
CID 22497485
(1R)-1-[2-(2-methylpentoxy)phenyl]ethanamine
CID 63367049
4-(2-butan-2-ylphenoxy)butan-2-amine
CID 43118978

Frequently Asked Questions

What is the IUPAC name of O-(2-pentan-2-ylphenyl)hydroxylamine?
The IUPAC name of O-(2-pentan-2-ylphenyl)hydroxylamine (CID 173492752) is O-(2-pentan-2-ylphenyl)hydroxylamine.
What is the SMILES notation for O-(2-pentan-2-ylphenyl)hydroxylamine?
The canonical SMILES for O-(2-pentan-2-ylphenyl)hydroxylamine is CCCC(C)c1ccccc1ON.
What is the InChIKey of O-(2-pentan-2-ylphenyl)hydroxylamine?
The InChIKey is DUBWZFDUTGGCAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-3-6-9(2)10-7-4-5-8-11(10)13-12/h4-5,7-9H,3,6,12H2,1-2H3.
What are the key properties of O-(2-pentan-2-ylphenyl)hydroxylamine?
O-(2-pentan-2-ylphenyl)hydroxylamine has a molecular weight of 179.26 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-(2-pentan-2-ylphenyl)hydroxylamine is sourced from PubChem (CID 173492752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).