(2,5-diethylphenyl)-piperidin-2-ylmethanol

C16H25NO — CID 64866605

IUPAC(2,5-diethylphenyl)-piperidin-2-ylmethanol
SMILESCCc1ccc(CC)c(C(O)C2CCCCN2)c1
InChIInChI=1S/C16H25NO/c1-3-12-8-9-13(4-2)14(11-12)16(18)15-7-5-6-10-17-15/h8-9,11,15-18H,3-7,10H2,1-2H3
InChIKeyLSATXRJUSVLPAI-UHFFFAOYSA-N
MW247.38 g/mol
LogP2.99
Rot. Bonds4

About (2,5-diethylphenyl)-piperidin-2-ylmethanol

(2,5-diethylphenyl)-piperidin-2-ylmethanol (PubChem CID 64866605) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is (2,5-diethylphenyl)-piperidin-2-ylmethanol.

Molecular Properties

Compound Name(2,5-diethylphenyl)-piperidin-2-ylmethanol
PubChem CID64866605
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name(2,5-diethylphenyl)-piperidin-2-ylmethanol
SMILESCCc1ccc(CC)c(C(O)C2CCCCN2)c1
InChIInChI=1S/C16H25NO/c1-3-12-8-9-13(4-2)14(11-12)16(18)15-7-5-6-10-17-15/h8-9,11,15-18H,3-7,10H2,1-2H3
InChIKeyLSATXRJUSVLPAI-UHFFFAOYSA-N
XLogP2.99
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2,5-diethylphenyl)-piperidin-2-ylmethanol?
The IUPAC name of (2,5-diethylphenyl)-piperidin-2-ylmethanol (CID 64866605) is (2,5-diethylphenyl)-piperidin-2-ylmethanol.
What is the SMILES notation for (2,5-diethylphenyl)-piperidin-2-ylmethanol?
The canonical SMILES for (2,5-diethylphenyl)-piperidin-2-ylmethanol is CCc1ccc(CC)c(C(O)C2CCCCN2)c1.
What is the InChIKey of (2,5-diethylphenyl)-piperidin-2-ylmethanol?
The InChIKey is LSATXRJUSVLPAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-3-12-8-9-13(4-2)14(11-12)16(18)15-7-5-6-10-17-15/h8-9,11,15-18H,3-7,10H2,1-2H3.
What are the key properties of (2,5-diethylphenyl)-piperidin-2-ylmethanol?
(2,5-diethylphenyl)-piperidin-2-ylmethanol has a molecular weight of 247.38 g/mol, XLogP of 2.99, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-diethylphenyl)-piperidin-2-ylmethanol is sourced from PubChem (CID 64866605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).