(4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol

C19H29FN2O — CID 111434911

IUPAC(4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol
SMILESOC(c1ccc(F)cc1)C1CCN(CCN2CCCCC2)CC1
InChIInChI=1S/C19H29FN2O/c20-18-6-4-16(5-7-18)19(23)17-8-12-22(13-9-17)15-14-21-10-2-1-3-11-21/h4-7,17,19,23H,1-3,8-15H2
InChIKeySZTCEPIQHSPZCK-UHFFFAOYSA-N
MW320.45 g/mol
LogP3.06
Rot. Bonds5

About (4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol

(4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol (PubChem CID 111434911) has the molecular formula C19H29FN2O and a molecular weight of 320.45 g/mol. Its IUPAC name is (4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name(4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol
PubChem CID111434911
Molecular FormulaC19H29FN2O
Molecular Weight320.45 g/mol
Exact Mass320.23
IUPAC Name(4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol
SMILESOC(c1ccc(F)cc1)C1CCN(CCN2CCCCC2)CC1
InChIInChI=1S/C19H29FN2O/c20-18-6-4-16(5-7-18)19(23)17-8-12-22(13-9-17)15-14-21-10-2-1-3-11-21/h4-7,17,19,23H,1-3,8-15H2
InChIKeySZTCEPIQHSPZCK-UHFFFAOYSA-N
XLogP3.06
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.45
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[3-(4-fluorophenoxy)propyl]piperidin-4-yl]-(4-fluorophenyl)methanol
CID 10737302
N-ethyl-3-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]propanamide
CID 111109172
3-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]-1-(2-methylpyrrolidin-1-yl)propan-1-one
CID 111487961
2-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]-N,N-dimethylacetamide
CID 111109219
(4-fluorophenyl)-[1-(1,2-oxazol-5-ylmethyl)piperidin-4-yl]methanol
CID 167986384
2-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]-1-piperidin-1-ylpropan-1-one
CID 111109463
(4-fluorophenyl)-(1-methylpiperidin-3-yl)methanol
CID 142412324
1-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]-3-phenoxypropan-2-ol
CID 138959633
2-ethyl-1-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]butan-1-one
CID 111434247
2-(3,4-dimethoxyphenyl)-4-[4-[(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]butanenitrile
CID 67835274
[1-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]piperidin-4-yl]-(4-fluorophenyl)methanol
CID 111109144
(R)-(4-fluorophenyl)-[1-[(5-methyl-3-pyridinyl)methyl]piperidin-4-yl]methanol
CID 124621837

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol?
The IUPAC name of (4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol (CID 111434911) is (4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol.
What is the SMILES notation for (4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol?
The canonical SMILES for (4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol is OC(c1ccc(F)cc1)C1CCN(CCN2CCCCC2)CC1.
What is the InChIKey of (4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol?
The InChIKey is SZTCEPIQHSPZCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29FN2O/c20-18-6-4-16(5-7-18)19(23)17-8-12-22(13-9-17)15-14-21-10-2-1-3-11-21/h4-7,17,19,23H,1-3,8-15H2.
What are the key properties of (4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol?
(4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol has a molecular weight of 320.45 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-[1-(2-piperidin-1-ylethyl)piperidin-4-yl]methanol is sourced from PubChem (CID 111434911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).