4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol

C18H27FN2O — CID 6487628

IUPAC4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol
SMILESOC1(c2ccccc2F)CCN(CCN2CCCCC2)CC1
InChIInChI=1S/C18H27FN2O/c19-17-7-3-2-6-16(17)18(22)8-12-21(13-9-18)15-14-20-10-4-1-5-11-20/h2-3,6-7,22H,1,4-5,8-15H2
InChIKeyRDIZDIAXGKPAIY-UHFFFAOYSA-N
MW306.42 g/mol
LogP2.60
Rot. Bonds4

About 4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol

4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol (PubChem CID 6487628) has the molecular formula C18H27FN2O and a molecular weight of 306.42 g/mol. Its IUPAC name is 4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol.

Molecular Properties

Compound Name4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol
PubChem CID6487628
Molecular FormulaC18H27FN2O
Molecular Weight306.42 g/mol
Exact Mass306.21
IUPAC Name4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol
SMILESOC1(c2ccccc2F)CCN(CCN2CCCCC2)CC1
InChIInChI=1S/C18H27FN2O/c19-17-7-3-2-6-16(17)18(22)8-12-21(13-9-18)15-14-20-10-4-1-5-11-20/h2-3,6-7,22H,1,4-5,8-15H2
InChIKeyRDIZDIAXGKPAIY-UHFFFAOYSA-N
XLogP2.60
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.42
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol?
The IUPAC name of 4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol (CID 6487628) is 4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol.
What is the SMILES notation for 4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol?
The canonical SMILES for 4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol is OC1(c2ccccc2F)CCN(CCN2CCCCC2)CC1.
What is the InChIKey of 4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol?
The InChIKey is RDIZDIAXGKPAIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27FN2O/c19-17-7-3-2-6-16(17)18(22)8-12-21(13-9-18)15-14-20-10-4-1-5-11-20/h2-3,6-7,22H,1,4-5,8-15H2.
What are the key properties of 4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol?
4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol has a molecular weight of 306.42 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)-1-(2-piperidin-1-ylethyl)piperidin-4-ol is sourced from PubChem (CID 6487628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).