O-(4-butylphenyl)hydroxylamine

C10H15NO — CID 176620577

IUPACO-(4-butylphenyl)hydroxylamine
SMILESCCCCc1ccc(ON)cc1
InChIInChI=1S/C10H15NO/c1-2-3-4-9-5-7-10(12-11)8-6-9/h5-8H,2-4,11H2,1H3
InChIKeyYXQUJKWDPPNUCT-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.28
Rot. Bonds4

About O-(4-butylphenyl)hydroxylamine

O-(4-butylphenyl)hydroxylamine (PubChem CID 176620577) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is O-(4-butylphenyl)hydroxylamine.

Molecular Properties

Compound NameO-(4-butylphenyl)hydroxylamine
PubChem CID176620577
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC NameO-(4-butylphenyl)hydroxylamine
SMILESCCCCc1ccc(ON)cc1
InChIInChI=1S/C10H15NO/c1-2-3-4-9-5-7-10(12-11)8-6-9/h5-8H,2-4,11H2,1H3
InChIKeyYXQUJKWDPPNUCT-UHFFFAOYSA-N
XLogP2.28
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.28
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

1-tetracosyl-4-(4-tetracosylphenoxy)benzene
CID 57157299
1,4-bis[(4-butylphenyl)methyl]benzene
CID 58021495
1-butyl-4-[(4-butylphenyl)methyl]benzene
CID 57156341
1-butyl-4-nonylbenzene
CID 59545302
1-butyl-4-phosphorosooxybenzene
CID 66862853
4-[(4-butylphenoxy)methyl]aniline
CID 115492301
1-butyl-4-[(4-butylphenyl)methoxymethyl]benzene
CID 21471119
1-butyl-4-(4-chlorobutoxy)benzene
CID 115492522
1,4-bis[(4-butylphenyl)methyl]benzene;ethane
CID 91530011
O-[4-(5-decylpyrimidin-2-yl)phenyl]hydroxylamine
CID 90429249
3-(4-butylphenoxy)-2-methylpropan-1-amine
CID 115492916
(4-butylphenyl) sulfate
CID 59815367

Frequently Asked Questions

What is the IUPAC name of O-(4-butylphenyl)hydroxylamine?
The IUPAC name of O-(4-butylphenyl)hydroxylamine (CID 176620577) is O-(4-butylphenyl)hydroxylamine.
What is the SMILES notation for O-(4-butylphenyl)hydroxylamine?
The canonical SMILES for O-(4-butylphenyl)hydroxylamine is CCCCc1ccc(ON)cc1.
What is the InChIKey of O-(4-butylphenyl)hydroxylamine?
The InChIKey is YXQUJKWDPPNUCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-2-3-4-9-5-7-10(12-11)8-6-9/h5-8H,2-4,11H2,1H3.
What are the key properties of O-(4-butylphenyl)hydroxylamine?
O-(4-butylphenyl)hydroxylamine has a molecular weight of 165.24 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-(4-butylphenyl)hydroxylamine is sourced from PubChem (CID 176620577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).