4-[(2R)-2-(3-aminophenyl)propyl]phenol

C15H17NO — CID 174733885

IUPAC4-[(2R)-2-(3-aminophenyl)propyl]phenol
SMILESC[C@H](Cc1ccc(O)cc1)c1cccc(N)c1
InChIInChI=1S/C15H17NO/c1-11(13-3-2-4-14(16)10-13)9-12-5-7-15(17)8-6-12/h2-8,10-11,17H,9,16H2,1H3/t11-/m1/s1
InChIKeySYFUAZISIAZSDX-LLVKDONJSA-N
MW227.31 g/mol
LogP3.32
Rot. Bonds3

About 4-[(2R)-2-(3-aminophenyl)propyl]phenol

4-[(2R)-2-(3-aminophenyl)propyl]phenol (PubChem CID 174733885) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 4-[(2R)-2-(3-aminophenyl)propyl]phenol.

Molecular Properties

Compound Name4-[(2R)-2-(3-aminophenyl)propyl]phenol
PubChem CID174733885
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name4-[(2R)-2-(3-aminophenyl)propyl]phenol
SMILESC[C@H](Cc1ccc(O)cc1)c1cccc(N)c1
InChIInChI=1S/C15H17NO/c1-11(13-3-2-4-14(16)10-13)9-12-5-7-15(17)8-6-12/h2-8,10-11,17H,9,16H2,1H3/t11-/m1/s1
InChIKeySYFUAZISIAZSDX-LLVKDONJSA-N
XLogP3.32
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-[(2R)-2-(3-aminophenyl)propyl]phenol 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

4-[2-[3-[2-(3-propylphenyl)propyl]phenyl]propyl]phenol
CID 162462140
2,4-bis[1-(4-hydroxyphenyl)propan-2-yl]phenol
CID 69188652
3-[4-[2-[4-(3-aminophenoxy)phenyl]propyl]phenoxy]aniline
CID 18363747
2-(3-aminophenyl)-N-[2-(4-hydroxyphenyl)ethyl]propanamide
CID 106591189
3-(4-methylpentan-2-yl)aniline
CID 15215881
4-[1-[3-[2-(4-aminophenyl)propyl]phenyl]propan-2-yl]aniline;4-[1-[4-[2-(4-aminophenyl)propyl]phenyl]propan-2-yl]aniline
CID 67706104
3-[2-(4-aminophenyl)propyl]phenol
CID 70385210
4-[2-(4-fluorophenyl)propyl]phenol
CID 70071344
4-(2-aminopropyl)phenol;dihydrobromide
CID 23615767
4-[(2S)-2-aminopropyl]phenol;methanol
CID 142971966
4-[(2S)-2-aminopropyl]phenol;hydrochloride
CID 90673532
1,4-bis(2-phenylpropyl)benzene
CID 19376086

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-2-(3-aminophenyl)propyl]phenol?
The IUPAC name of 4-[(2R)-2-(3-aminophenyl)propyl]phenol (CID 174733885) is 4-[(2R)-2-(3-aminophenyl)propyl]phenol.
What is the SMILES notation for 4-[(2R)-2-(3-aminophenyl)propyl]phenol?
The canonical SMILES for 4-[(2R)-2-(3-aminophenyl)propyl]phenol is C[C@H](Cc1ccc(O)cc1)c1cccc(N)c1.
What is the InChIKey of 4-[(2R)-2-(3-aminophenyl)propyl]phenol?
The InChIKey is SYFUAZISIAZSDX-LLVKDONJSA-N. The full InChI is InChI=1S/C15H17NO/c1-11(13-3-2-4-14(16)10-13)9-12-5-7-15(17)8-6-12/h2-8,10-11,17H,9,16H2,1H3/t11-/m1/s1.
What are the key properties of 4-[(2R)-2-(3-aminophenyl)propyl]phenol?
4-[(2R)-2-(3-aminophenyl)propyl]phenol has a molecular weight of 227.31 g/mol, XLogP of 3.32, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-2-(3-aminophenyl)propyl]phenol is sourced from PubChem (CID 174733885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).