N-ethyl-N-(3-phenylpropyl)hydroxylamine

C11H17NO — CID 146633464

IUPACN-ethyl-N-(3-phenylpropyl)hydroxylamine
SMILESCCN(O)CCCc1ccccc1
InChIInChI=1S/C11H17NO/c1-2-12(13)10-6-9-11-7-4-3-5-8-11/h3-5,7-8,13H,2,6,9-10H2,1H3
InChIKeyXUFKNRGEPRLXAU-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.33
Rot. Bonds5

About N-ethyl-N-(3-phenylpropyl)hydroxylamine

N-ethyl-N-(3-phenylpropyl)hydroxylamine (PubChem CID 146633464) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is N-ethyl-N-(3-phenylpropyl)hydroxylamine.

Molecular Properties

Compound NameN-ethyl-N-(3-phenylpropyl)hydroxylamine
PubChem CID146633464
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC NameN-ethyl-N-(3-phenylpropyl)hydroxylamine
SMILESCCN(O)CCCc1ccccc1
InChIInChI=1S/C11H17NO/c1-2-12(13)10-6-9-11-7-4-3-5-8-11/h3-5,7-8,13H,2,6,9-10H2,1H3
InChIKeyXUFKNRGEPRLXAU-UHFFFAOYSA-N
XLogP2.33
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-ethyl-N-(3-phenylpropyl)hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-diethyl-3-phenylpropan-1-amine;hydrate
CID 172794416
azane;N,N-diethyl-3-phenylpropan-1-amine;hydroiodide
CID 175520694
1-[ethyl(3-phenylpropyl)amino]-2-methylpropan-2-ol
CID 78962338
N'-ethyl-N,N-dimethyl-N'-(3-phenylpropyl)ethane-1,2-diamine
CID 2059221
N-ethyl-N-(5-phenylpentyl)aniline
CID 57010126
N'-ethyl-N'-(3-phenylpropyl)propane-1,3-diamine
CID 43137195
N,N-diethyl-12-phenyldodecan-1-amine;hydrate
CID 173447962
N,N-diethyl-17-phenylheptadecan-1-amine;hydrochloride
CID 173450606
N,N-diethyl-12-phenyldodecan-1-amine;hydrochloride
CID 173450518
2-[ethyl(4-phenylbutyl)amino]ethanol
CID 114334503
hexylbenzene;hydrogen peroxide
CID 90001206
butylbenzene;hydroxylamine
CID 175142403

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-phenylpropyl)hydroxylamine?
The IUPAC name of N-ethyl-N-(3-phenylpropyl)hydroxylamine (CID 146633464) is N-ethyl-N-(3-phenylpropyl)hydroxylamine.
What is the SMILES notation for N-ethyl-N-(3-phenylpropyl)hydroxylamine?
The canonical SMILES for N-ethyl-N-(3-phenylpropyl)hydroxylamine is CCN(O)CCCc1ccccc1.
What is the InChIKey of N-ethyl-N-(3-phenylpropyl)hydroxylamine?
The InChIKey is XUFKNRGEPRLXAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-2-12(13)10-6-9-11-7-4-3-5-8-11/h3-5,7-8,13H,2,6,9-10H2,1H3.
What are the key properties of N-ethyl-N-(3-phenylpropyl)hydroxylamine?
N-ethyl-N-(3-phenylpropyl)hydroxylamine has a molecular weight of 179.26 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-phenylpropyl)hydroxylamine is sourced from PubChem (CID 146633464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).