4-(4-propylpiperidin-1-yl)phenol

C14H21NO — CID 165358736

IUPAC4-(4-propylpiperidin-1-yl)phenol
SMILESCCCC1CCN(c2ccc(O)cc2)CC1
InChIInChI=1S/C14H21NO/c1-2-3-12-8-10-15(11-9-12)13-4-6-14(16)7-5-13/h4-7,12,16H,2-3,8-11H2,1H3
InChIKeyDPHNTCHSLMBHJQ-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.41
Rot. Bonds3

About 4-(4-propylpiperidin-1-yl)phenol

4-(4-propylpiperidin-1-yl)phenol (PubChem CID 165358736) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 4-(4-propylpiperidin-1-yl)phenol.

Molecular Properties

Compound Name4-(4-propylpiperidin-1-yl)phenol
PubChem CID165358736
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name4-(4-propylpiperidin-1-yl)phenol
SMILESCCCC1CCN(c2ccc(O)cc2)CC1
InChIInChI=1S/C14H21NO/c1-2-3-12-8-10-15(11-9-12)13-4-6-14(16)7-5-13/h4-7,12,16H,2-3,8-11H2,1H3
InChIKeyDPHNTCHSLMBHJQ-UHFFFAOYSA-N
XLogP3.41
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4-propylpiperidin-1-yl)phenol?
The IUPAC name of 4-(4-propylpiperidin-1-yl)phenol (CID 165358736) is 4-(4-propylpiperidin-1-yl)phenol.
What is the SMILES notation for 4-(4-propylpiperidin-1-yl)phenol?
The canonical SMILES for 4-(4-propylpiperidin-1-yl)phenol is CCCC1CCN(c2ccc(O)cc2)CC1.
What is the InChIKey of 4-(4-propylpiperidin-1-yl)phenol?
The InChIKey is DPHNTCHSLMBHJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-2-3-12-8-10-15(11-9-12)13-4-6-14(16)7-5-13/h4-7,12,16H,2-3,8-11H2,1H3.
What are the key properties of 4-(4-propylpiperidin-1-yl)phenol?
4-(4-propylpiperidin-1-yl)phenol has a molecular weight of 219.33 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-propylpiperidin-1-yl)phenol is sourced from PubChem (CID 165358736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).