O-[(2-cyclobutylphenyl)methyl]hydroxylamine

C11H15NO — CID 117277584

IUPACO-[(2-cyclobutylphenyl)methyl]hydroxylamine
SMILESNOCc1ccccc1C1CCC1
InChIInChI=1S/C11H15NO/c12-13-8-10-4-1-2-7-11(10)9-5-3-6-9/h1-2,4,7,9H,3,5-6,8,12H2
InChIKeyIKHUNXAPFSFZPW-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.34
Rot. Bonds3

About O-[(2-cyclobutylphenyl)methyl]hydroxylamine

O-[(2-cyclobutylphenyl)methyl]hydroxylamine (PubChem CID 117277584) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is O-[(2-cyclobutylphenyl)methyl]hydroxylamine.

Molecular Properties

Compound NameO-[(2-cyclobutylphenyl)methyl]hydroxylamine
PubChem CID117277584
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC NameO-[(2-cyclobutylphenyl)methyl]hydroxylamine
SMILESNOCc1ccccc1C1CCC1
InChIInChI=1S/C11H15NO/c12-13-8-10-4-1-2-7-11(10)9-5-3-6-9/h1-2,4,7,9H,3,5-6,8,12H2
InChIKeyIKHUNXAPFSFZPW-UHFFFAOYSA-N
XLogP2.34
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.34
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

O-[(2-cyclohexylphenyl)methyl]hydroxylamine
CID 117294074
O-[(2-cyclopropylphenyl)methyl]hydroxylamine
CID 130051867
O-[[2-(1-methylazetidin-3-yl)phenyl]methyl]hydroxylamine
CID 117283250
1-(2-bromoethyl)-2-cyclobutylbenzene
CID 114605787
2-(2-cycloheptylphenyl)ethanamine
CID 83836329
O-[2-(2-piperidin-4-ylphenyl)ethyl]hydroxylamine
CID 117314763
3-(2-cyclobutylphenyl)-2-methylpropan-1-amine
CID 114606308
1-(2-cyclopentylphenyl)propan-2-one
CID 83832084
2-(2-cyclopentylphenyl)acetamide
CID 68862878
3-(2-cyclobutylphenyl)-1-phenylpropan-1-amine
CID 114606196
(2-cyclopropylphenyl)methyl trifluoromethanesulfonate
CID 102621470
tricyclo[6.2.2.02,7]dodeca-2,4,6-triene
CID 582301

Frequently Asked Questions

What is the IUPAC name of O-[(2-cyclobutylphenyl)methyl]hydroxylamine?
The IUPAC name of O-[(2-cyclobutylphenyl)methyl]hydroxylamine (CID 117277584) is O-[(2-cyclobutylphenyl)methyl]hydroxylamine.
What is the SMILES notation for O-[(2-cyclobutylphenyl)methyl]hydroxylamine?
The canonical SMILES for O-[(2-cyclobutylphenyl)methyl]hydroxylamine is NOCc1ccccc1C1CCC1.
What is the InChIKey of O-[(2-cyclobutylphenyl)methyl]hydroxylamine?
The InChIKey is IKHUNXAPFSFZPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c12-13-8-10-4-1-2-7-11(10)9-5-3-6-9/h1-2,4,7,9H,3,5-6,8,12H2.
What are the key properties of O-[(2-cyclobutylphenyl)methyl]hydroxylamine?
O-[(2-cyclobutylphenyl)methyl]hydroxylamine has a molecular weight of 177.25 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-[(2-cyclobutylphenyl)methyl]hydroxylamine is sourced from PubChem (CID 117277584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).