[3-[(3-phenylcyclobutyl)amino]phenyl]methanol

C17H19NO — CID 43715189

IUPAC[3-[(3-phenylcyclobutyl)amino]phenyl]methanol
SMILESOCc1cccc(NC2CC(c3ccccc3)C2)c1
InChIInChI=1S/C17H19NO/c19-12-13-5-4-8-16(9-13)18-17-10-15(11-17)14-6-2-1-3-7-14/h1-9,15,17-19H,10-12H2
InChIKeySKAGXAITHPCYCV-UHFFFAOYSA-N
MW253.35 g/mol
LogP3.54
Rot. Bonds4

About [3-[(3-phenylcyclobutyl)amino]phenyl]methanol

[3-[(3-phenylcyclobutyl)amino]phenyl]methanol (PubChem CID 43715189) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is [3-[(3-phenylcyclobutyl)amino]phenyl]methanol.

Molecular Properties

Compound Name[3-[(3-phenylcyclobutyl)amino]phenyl]methanol
PubChem CID43715189
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name[3-[(3-phenylcyclobutyl)amino]phenyl]methanol
SMILESOCc1cccc(NC2CC(c3ccccc3)C2)c1
InChIInChI=1S/C17H19NO/c19-12-13-5-4-8-16(9-13)18-17-10-15(11-17)14-6-2-1-3-7-14/h1-9,15,17-19H,10-12H2
InChIKeySKAGXAITHPCYCV-UHFFFAOYSA-N
XLogP3.54
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-[(3-phenylcyclobutyl)amino]phenyl]methanol?
The IUPAC name of [3-[(3-phenylcyclobutyl)amino]phenyl]methanol (CID 43715189) is [3-[(3-phenylcyclobutyl)amino]phenyl]methanol.
What is the SMILES notation for [3-[(3-phenylcyclobutyl)amino]phenyl]methanol?
The canonical SMILES for [3-[(3-phenylcyclobutyl)amino]phenyl]methanol is OCc1cccc(NC2CC(c3ccccc3)C2)c1.
What is the InChIKey of [3-[(3-phenylcyclobutyl)amino]phenyl]methanol?
The InChIKey is SKAGXAITHPCYCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c19-12-13-5-4-8-16(9-13)18-17-10-15(11-17)14-6-2-1-3-7-14/h1-9,15,17-19H,10-12H2.
What are the key properties of [3-[(3-phenylcyclobutyl)amino]phenyl]methanol?
[3-[(3-phenylcyclobutyl)amino]phenyl]methanol has a molecular weight of 253.35 g/mol, XLogP of 3.54, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(3-phenylcyclobutyl)amino]phenyl]methanol is sourced from PubChem (CID 43715189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).