4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol

C15H24N2O — CID 90012734

IUPAC4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol
SMILESCC(C)(C)N1CCC(O)(c2ccc(N)cc2)CC1
InChIInChI=1S/C15H24N2O/c1-14(2,3)17-10-8-15(18,9-11-17)12-4-6-13(16)7-5-12/h4-7,18H,8-11,16H2,1-3H3
InChIKeyBNFNDZPLWAWALB-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.35
Rot. Bonds1

About 4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol

4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol (PubChem CID 90012734) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol.

Molecular Properties

Compound Name4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol
PubChem CID90012734
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol
SMILESCC(C)(C)N1CCC(O)(c2ccc(N)cc2)CC1
InChIInChI=1S/C15H24N2O/c1-14(2,3)17-10-8-15(18,9-11-17)12-4-6-13(16)7-5-12/h4-7,18H,8-11,16H2,1-3H3
InChIKeyBNFNDZPLWAWALB-UHFFFAOYSA-N
XLogP2.35
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol?
The IUPAC name of 4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol (CID 90012734) is 4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol.
What is the SMILES notation for 4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol?
The canonical SMILES for 4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol is CC(C)(C)N1CCC(O)(c2ccc(N)cc2)CC1.
What is the InChIKey of 4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol?
The InChIKey is BNFNDZPLWAWALB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-14(2,3)17-10-8-15(18,9-11-17)12-4-6-13(16)7-5-12/h4-7,18H,8-11,16H2,1-3H3.
What are the key properties of 4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol?
4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol has a molecular weight of 248.37 g/mol, XLogP of 2.35, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-aminophenyl)-1-tert-butylpiperidin-4-ol is sourced from PubChem (CID 90012734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).