2-(4-phenoxyphenyl)propan-1-amine

C15H17NO — CID 16736129

IUPAC2-(4-phenoxyphenyl)propan-1-amine
SMILESCC(CN)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C15H17NO/c1-12(11-16)13-7-9-15(10-8-13)17-14-5-3-2-4-6-14/h2-10,12H,11,16H2,1H3
InChIKeyFWQFTPRHHZEGHY-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.54
Rot. Bonds4

About 2-(4-phenoxyphenyl)propan-1-amine

2-(4-phenoxyphenyl)propan-1-amine (PubChem CID 16736129) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-(4-phenoxyphenyl)propan-1-amine.

Molecular Properties

Compound Name2-(4-phenoxyphenyl)propan-1-amine
PubChem CID16736129
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name2-(4-phenoxyphenyl)propan-1-amine
SMILESCC(CN)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C15H17NO/c1-12(11-16)13-7-9-15(10-8-13)17-14-5-3-2-4-6-14/h2-10,12H,11,16H2,1H3
InChIKeyFWQFTPRHHZEGHY-UHFFFAOYSA-N
XLogP3.54
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[4-(1-aminopropan-2-yl)phenoxy]benzonitrile
CID 116996793
3-(4-phenoxyphenyl)butanethioamide
CID 83938971
(1S)-2-amino-1-(4-phenoxyphenyl)ethanol
CID 39247565
3-[4-(4-phenoxyphenoxy)phenyl]butanoic acid
CID 70842776
2-amino-5-(4-phenoxyphenyl)hexan-3-ol
CID 83939023
2-[1-(4-phenoxyphenyl)ethoxy]ethanamine
CID 112512699
2-[4-(phenylmethoxymethyl)phenyl]propan-1-amine
CID 105349042
1-(1-chloroethyl)-4-phenoxybenzene
CID 18342950
1-(4-phenoxyphenyl)ethanol;hydrochloride
CID 67663526
3-(4-phenoxyphenyl)butyl thiocyanate
CID 112719261
(1S)-N-methyl-1-(4-phenoxyphenyl)ethanamine
CID 67664030
1-(3,3-dimethylbutan-2-yl)-4-phenoxybenzene
CID 59819110

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenoxyphenyl)propan-1-amine?
The IUPAC name of 2-(4-phenoxyphenyl)propan-1-amine (CID 16736129) is 2-(4-phenoxyphenyl)propan-1-amine.
What is the SMILES notation for 2-(4-phenoxyphenyl)propan-1-amine?
The canonical SMILES for 2-(4-phenoxyphenyl)propan-1-amine is CC(CN)c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 2-(4-phenoxyphenyl)propan-1-amine?
The InChIKey is FWQFTPRHHZEGHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-12(11-16)13-7-9-15(10-8-13)17-14-5-3-2-4-6-14/h2-10,12H,11,16H2,1H3.
What are the key properties of 2-(4-phenoxyphenyl)propan-1-amine?
2-(4-phenoxyphenyl)propan-1-amine has a molecular weight of 227.31 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenoxyphenyl)propan-1-amine is sourced from PubChem (CID 16736129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).