N-(3-methyl-2-phenylbutyl)hydroxylamine

C11H17NO — CID 15169464

IUPACN-(3-methyl-2-phenylbutyl)hydroxylamine
SMILESCC(C)C(CNO)c1ccccc1
InChIInChI=1S/C11H17NO/c1-9(2)11(8-12-13)10-6-4-3-5-7-10/h3-7,9,11-13H,8H2,1-2H3
InChIKeyGPMWAZAPKZLEEF-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.40
Rot. Bonds4

About N-(3-methyl-2-phenylbutyl)hydroxylamine

N-(3-methyl-2-phenylbutyl)hydroxylamine (PubChem CID 15169464) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is N-(3-methyl-2-phenylbutyl)hydroxylamine.

Molecular Properties

Compound NameN-(3-methyl-2-phenylbutyl)hydroxylamine
PubChem CID15169464
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC NameN-(3-methyl-2-phenylbutyl)hydroxylamine
SMILESCC(C)C(CNO)c1ccccc1
InChIInChI=1S/C11H17NO/c1-9(2)11(8-12-13)10-6-4-3-5-7-10/h3-7,9,11-13H,8H2,1-2H3
InChIKeyGPMWAZAPKZLEEF-UHFFFAOYSA-N
XLogP2.40
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(3-methyl-2-phenylbutyl)acetamide;hydrochloride
CID 119294102
3-methyl-3-[(3-methyl-2-phenylbutyl)amino]butan-2-ol
CID 107876430
1-[(3-methyl-2-phenylbutyl)amino]butan-2-ol
CID 104952529
N-(3-methyl-2-phenylbutyl)hexan-3-amine
CID 114011776
4-methyl-3-phenylpentanoic acid
CID 3249521
2-methyl-3-(methylamino)-N-(3-methyl-2-phenylbutyl)propanamide
CID 119732056
N-methyl-2-[(3-methyl-2-phenylbutyl)amino]acetamide
CID 107875908
3-methyl-2-phenyl-N-prop-2-enylbutan-1-amine
CID 107875745
2-methyl-N-(3-methyl-2-phenylbutyl)aniline
CID 107875833
2-methyl-2-[(3-methyl-2-phenylbutyl)amino]butan-1-ol
CID 107876200
2,2-dimethyl-N-(3-methyl-2-phenylbutyl)cyclopropan-1-amine
CID 107876110
N-(3-methyl-2-phenylbutyl)-2-methylsulfanylaniline
CID 107875943

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2-phenylbutyl)hydroxylamine?
The IUPAC name of N-(3-methyl-2-phenylbutyl)hydroxylamine (CID 15169464) is N-(3-methyl-2-phenylbutyl)hydroxylamine.
What is the SMILES notation for N-(3-methyl-2-phenylbutyl)hydroxylamine?
The canonical SMILES for N-(3-methyl-2-phenylbutyl)hydroxylamine is CC(C)C(CNO)c1ccccc1.
What is the InChIKey of N-(3-methyl-2-phenylbutyl)hydroxylamine?
The InChIKey is GPMWAZAPKZLEEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-9(2)11(8-12-13)10-6-4-3-5-7-10/h3-7,9,11-13H,8H2,1-2H3.
What are the key properties of N-(3-methyl-2-phenylbutyl)hydroxylamine?
N-(3-methyl-2-phenylbutyl)hydroxylamine has a molecular weight of 179.26 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2-phenylbutyl)hydroxylamine is sourced from PubChem (CID 15169464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).