2-(cyclohexylamino)-2-phenylpropan-1-ol

C15H23NO — CID 61045452

IUPAC2-(cyclohexylamino)-2-phenylpropan-1-ol
SMILESCC(CO)(NC1CCCCC1)c1ccccc1
InChIInChI=1S/C15H23NO/c1-15(12-17,13-8-4-2-5-9-13)16-14-10-6-3-7-11-14/h2,4-5,8-9,14,16-17H,3,6-7,10-12H2,1H3
InChIKeyNKFRTHCEBGIRII-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.82
Rot. Bonds4

About 2-(cyclohexylamino)-2-phenylpropan-1-ol

2-(cyclohexylamino)-2-phenylpropan-1-ol (PubChem CID 61045452) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 2-(cyclohexylamino)-2-phenylpropan-1-ol.

Molecular Properties

Compound Name2-(cyclohexylamino)-2-phenylpropan-1-ol
PubChem CID61045452
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name2-(cyclohexylamino)-2-phenylpropan-1-ol
SMILESCC(CO)(NC1CCCCC1)c1ccccc1
InChIInChI=1S/C15H23NO/c1-15(12-17,13-8-4-2-5-9-13)16-14-10-6-3-7-11-14/h2,4-5,8-9,14,16-17H,3,6-7,10-12H2,1H3
InChIKeyNKFRTHCEBGIRII-UHFFFAOYSA-N
XLogP2.82
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylamino)-2-phenylpropan-1-ol?
The IUPAC name of 2-(cyclohexylamino)-2-phenylpropan-1-ol (CID 61045452) is 2-(cyclohexylamino)-2-phenylpropan-1-ol.
What is the SMILES notation for 2-(cyclohexylamino)-2-phenylpropan-1-ol?
The canonical SMILES for 2-(cyclohexylamino)-2-phenylpropan-1-ol is CC(CO)(NC1CCCCC1)c1ccccc1.
What is the InChIKey of 2-(cyclohexylamino)-2-phenylpropan-1-ol?
The InChIKey is NKFRTHCEBGIRII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-15(12-17,13-8-4-2-5-9-13)16-14-10-6-3-7-11-14/h2,4-5,8-9,14,16-17H,3,6-7,10-12H2,1H3.
What are the key properties of 2-(cyclohexylamino)-2-phenylpropan-1-ol?
2-(cyclohexylamino)-2-phenylpropan-1-ol has a molecular weight of 233.36 g/mol, XLogP of 2.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylamino)-2-phenylpropan-1-ol is sourced from PubChem (CID 61045452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).