3-[2-(4-phenylphenyl)ethylamino]propan-1-ol

C17H21NO — CID 115217026

IUPAC3-[2-(4-phenylphenyl)ethylamino]propan-1-ol
SMILESOCCCNCCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H21NO/c19-14-4-12-18-13-11-15-7-9-17(10-8-15)16-5-2-1-3-6-16/h1-3,5-10,18-19H,4,11-14H2
InChIKeyLOHRGGKYCBJBSS-UHFFFAOYSA-N
MW255.36 g/mol
LogP2.87
Rot. Bonds7

About 3-[2-(4-phenylphenyl)ethylamino]propan-1-ol

3-[2-(4-phenylphenyl)ethylamino]propan-1-ol (PubChem CID 115217026) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 3-[2-(4-phenylphenyl)ethylamino]propan-1-ol.

Molecular Properties

Compound Name3-[2-(4-phenylphenyl)ethylamino]propan-1-ol
PubChem CID115217026
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name3-[2-(4-phenylphenyl)ethylamino]propan-1-ol
SMILESOCCCNCCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H21NO/c19-14-4-12-18-13-11-15-7-9-17(10-8-15)16-5-2-1-3-6-16/h1-3,5-10,18-19H,4,11-14H2
InChIKeyLOHRGGKYCBJBSS-UHFFFAOYSA-N
XLogP2.87
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(4-phenylphenyl)butan-1-ol
CID 11970468
4-[2-(4-phenylphenyl)ethylamino]butanenitrile
CID 115231915
2-[6-(2-phenylethylamino)hexylamino]ethanol
CID 22104030
4-[2-(4-methylphenyl)ethylamino]butan-1-ol
CID 115217735
5-(4-phenylbutylamino)pentan-1-ol
CID 107317257
N-(2-methoxyethyl)-2-(4-phenylphenyl)ethanamine
CID 64866230
2-(3-phenylpropylamino)ethanol
CID 19012091
N,N'-bis(2-phenylethyl)octane-1,8-diamine;dihydrobromide
CID 3029610
3-phenyl-N-(2-phenylethyl)propan-1-amine;hydrochloride
CID 54603294
N,N'-bis(2-phenylethyl)heptane-1,7-diamine;dihydrobromide
CID 3028511
N-(methoxymethyl)-2-(4-phenylphenyl)ethanamine
CID 115258845
N,N'-bis[(4-phenylphenyl)methyl]butane-1,4-diamine
CID 10273675

Frequently Asked Questions

What is the IUPAC name of 3-[2-(4-phenylphenyl)ethylamino]propan-1-ol?
The IUPAC name of 3-[2-(4-phenylphenyl)ethylamino]propan-1-ol (CID 115217026) is 3-[2-(4-phenylphenyl)ethylamino]propan-1-ol.
What is the SMILES notation for 3-[2-(4-phenylphenyl)ethylamino]propan-1-ol?
The canonical SMILES for 3-[2-(4-phenylphenyl)ethylamino]propan-1-ol is OCCCNCCc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 3-[2-(4-phenylphenyl)ethylamino]propan-1-ol?
The InChIKey is LOHRGGKYCBJBSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c19-14-4-12-18-13-11-15-7-9-17(10-8-15)16-5-2-1-3-6-16/h1-3,5-10,18-19H,4,11-14H2.
What are the key properties of 3-[2-(4-phenylphenyl)ethylamino]propan-1-ol?
3-[2-(4-phenylphenyl)ethylamino]propan-1-ol has a molecular weight of 255.36 g/mol, XLogP of 2.87, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(4-phenylphenyl)ethylamino]propan-1-ol is sourced from PubChem (CID 115217026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).