2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol

C14H21NO — CID 164753381

IUPAC2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol
SMILESCc1cc(C2CCC(C)CN2)cc(C)c1O
InChIInChI=1S/C14H21NO/c1-9-4-5-13(15-8-9)12-6-10(2)14(16)11(3)7-12/h6-7,9,13,15-16H,4-5,8H2,1-3H3
InChIKeyKIUBJWXHRXRDLZ-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.07
Rot. Bonds1

About 2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol

2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol (PubChem CID 164753381) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol.

Molecular Properties

Compound Name2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol
PubChem CID164753381
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol
SMILESCc1cc(C2CCC(C)CN2)cc(C)c1O
InChIInChI=1S/C14H21NO/c1-9-4-5-13(15-8-9)12-6-10(2)14(16)11(3)7-12/h6-7,9,13,15-16H,4-5,8H2,1-3H3
InChIKeyKIUBJWXHRXRDLZ-UHFFFAOYSA-N
XLogP3.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol?
The IUPAC name of 2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol (CID 164753381) is 2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol.
What is the SMILES notation for 2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol?
The canonical SMILES for 2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol is Cc1cc(C2CCC(C)CN2)cc(C)c1O.
What is the InChIKey of 2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol?
The InChIKey is KIUBJWXHRXRDLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-9-4-5-13(15-8-9)12-6-10(2)14(16)11(3)7-12/h6-7,9,13,15-16H,4-5,8H2,1-3H3.
What are the key properties of 2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol?
2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol has a molecular weight of 219.33 g/mol, XLogP of 3.07, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-(5-methylpiperidin-2-yl)phenol is sourced from PubChem (CID 164753381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).