1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine

C16H25ClN2O — CID 58420805

IUPAC1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine
SMILESCC1(C)CC(N)CC(C)(C)N1OCc1ccc(Cl)cc1
InChIInChI=1S/C16H25ClN2O/c1-15(2)9-14(18)10-16(3,4)19(15)20-11-12-5-7-13(17)8-6-12/h5-8,14H,9-11,18H2,1-4H3
InChIKeyQVZYBUQXSBJFEF-UHFFFAOYSA-N
MW296.84 g/mol
LogP3.75
Rot. Bonds3

About 1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine

1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine (PubChem CID 58420805) has the molecular formula C16H25ClN2O and a molecular weight of 296.84 g/mol. Its IUPAC name is 1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine.

Molecular Properties

Compound Name1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine
PubChem CID58420805
Molecular FormulaC16H25ClN2O
Molecular Weight296.84 g/mol
Exact Mass296.17
IUPAC Name1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine
SMILESCC1(C)CC(N)CC(C)(C)N1OCc1ccc(Cl)cc1
InChIInChI=1S/C16H25ClN2O/c1-15(2)9-14(18)10-16(3,4)19(15)20-11-12-5-7-13(17)8-6-12/h5-8,14H,9-11,18H2,1-4H3
InChIKeyQVZYBUQXSBJFEF-UHFFFAOYSA-N
XLogP3.75
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.84
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine?
The IUPAC name of 1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine (CID 58420805) is 1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine.
What is the SMILES notation for 1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine?
The canonical SMILES for 1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine is CC1(C)CC(N)CC(C)(C)N1OCc1ccc(Cl)cc1.
What is the InChIKey of 1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine?
The InChIKey is QVZYBUQXSBJFEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25ClN2O/c1-15(2)9-14(18)10-16(3,4)19(15)20-11-12-5-7-13(17)8-6-12/h5-8,14H,9-11,18H2,1-4H3.
What are the key properties of 1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine?
1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine has a molecular weight of 296.84 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-chlorophenyl)methoxy]-2,2,6,6-tetramethylpiperidin-4-amine is sourced from PubChem (CID 58420805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).