4-(2-amino-2-phenylcyclopropyl)phenol

C15H15NO — CID 84689947

IUPAC4-(2-amino-2-phenylcyclopropyl)phenol
SMILESNC1(c2ccccc2)CC1c1ccc(O)cc1
InChIInChI=1S/C15H15NO/c16-15(12-4-2-1-3-5-12)10-14(15)11-6-8-13(17)9-7-11/h1-9,14,17H,10,16H2
InChIKeyNWHSGKSANUYRJK-UHFFFAOYSA-N
MW225.29 g/mol
LogP2.73
Rot. Bonds2

About 4-(2-amino-2-phenylcyclopropyl)phenol

4-(2-amino-2-phenylcyclopropyl)phenol (PubChem CID 84689947) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 4-(2-amino-2-phenylcyclopropyl)phenol.

Molecular Properties

Compound Name4-(2-amino-2-phenylcyclopropyl)phenol
PubChem CID84689947
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name4-(2-amino-2-phenylcyclopropyl)phenol
SMILESNC1(c2ccccc2)CC1c1ccc(O)cc1
InChIInChI=1S/C15H15NO/c16-15(12-4-2-1-3-5-12)10-14(15)11-6-8-13(17)9-7-11/h1-9,14,17H,10,16H2
InChIKeyNWHSGKSANUYRJK-UHFFFAOYSA-N
XLogP2.73
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 ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-2-phenylcyclopropyl)phenol?
The IUPAC name of 4-(2-amino-2-phenylcyclopropyl)phenol (CID 84689947) is 4-(2-amino-2-phenylcyclopropyl)phenol.
What is the SMILES notation for 4-(2-amino-2-phenylcyclopropyl)phenol?
The canonical SMILES for 4-(2-amino-2-phenylcyclopropyl)phenol is NC1(c2ccccc2)CC1c1ccc(O)cc1.
What is the InChIKey of 4-(2-amino-2-phenylcyclopropyl)phenol?
The InChIKey is NWHSGKSANUYRJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c16-15(12-4-2-1-3-5-12)10-14(15)11-6-8-13(17)9-7-11/h1-9,14,17H,10,16H2.
What are the key properties of 4-(2-amino-2-phenylcyclopropyl)phenol?
4-(2-amino-2-phenylcyclopropyl)phenol has a molecular weight of 225.29 g/mol, XLogP of 2.73, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-2-phenylcyclopropyl)phenol is sourced from PubChem (CID 84689947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).