2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol

C15H15NO — CID 154731037

IUPAC2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol
SMILESN[C@H]1C[C@@H]1c1ccc(-c2ccccc2)cc1O
InChIInChI=1S/C15H15NO/c16-14-9-13(14)12-7-6-11(8-15(12)17)10-4-2-1-3-5-10/h1-8,13-14,17H,9,16H2/t13-,14+/m1/s1
InChIKeyDXNNLCBBNBFCFW-KGLIPLIRSA-N
MW225.29 g/mol
LogP2.87
Rot. Bonds2

About 2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol

2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol (PubChem CID 154731037) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol.

Molecular Properties

Compound Name2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol
PubChem CID154731037
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol
SMILESN[C@H]1C[C@@H]1c1ccc(-c2ccccc2)cc1O
InChIInChI=1S/C15H15NO/c16-14-9-13(14)12-7-6-11(8-15(12)17)10-4-2-1-3-5-10/h1-8,13-14,17H,9,16H2/t13-,14+/m1/s1
InChIKeyDXNNLCBBNBFCFW-KGLIPLIRSA-N
XLogP2.87
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol?
The IUPAC name of 2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol (CID 154731037) is 2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol.
What is the SMILES notation for 2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol?
The canonical SMILES for 2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol is N[C@H]1C[C@@H]1c1ccc(-c2ccccc2)cc1O.
What is the InChIKey of 2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol?
The InChIKey is DXNNLCBBNBFCFW-KGLIPLIRSA-N. The full InChI is InChI=1S/C15H15NO/c16-14-9-13(14)12-7-6-11(8-15(12)17)10-4-2-1-3-5-10/h1-8,13-14,17H,9,16H2/t13-,14+/m1/s1.
What are the key properties of 2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol?
2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol has a molecular weight of 225.29 g/mol, XLogP of 2.87, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R,2S)-2-aminocyclopropyl]-5-phenylphenol is sourced from PubChem (CID 154731037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).