4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol

C14H21FN2O — CID 82298197

IUPAC4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol
SMILESNCC1(O)CCN(CCc2ccccc2F)CC1
InChIInChI=1S/C14H21FN2O/c15-13-4-2-1-3-12(13)5-8-17-9-6-14(18,11-16)7-10-17/h1-4,18H,5-11,16H2
InChIKeySJRFOIKGOTYFFK-UHFFFAOYSA-N
MW252.33 g/mol
LogP1.15
Rot. Bonds4

About 4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol

4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol (PubChem CID 82298197) has the molecular formula C14H21FN2O and a molecular weight of 252.33 g/mol. Its IUPAC name is 4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol.

Molecular Properties

Compound Name4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol
PubChem CID82298197
Molecular FormulaC14H21FN2O
Molecular Weight252.33 g/mol
Exact Mass252.16
IUPAC Name4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol
SMILESNCC1(O)CCN(CCc2ccccc2F)CC1
InChIInChI=1S/C14H21FN2O/c15-13-4-2-1-3-12(13)5-8-17-9-6-14(18,11-16)7-10-17/h1-4,18H,5-11,16H2
InChIKeySJRFOIKGOTYFFK-UHFFFAOYSA-N
XLogP1.15
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.33
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-Phenylethyl)-4-piperidinol
CID 77055
4-(Aminomethyl)-1-benzylpiperidin-4-ol
CID 10421026
4-Hydroxy-1-(2-phenylethyl)-4-piperidinecarbonitrile
CID 32100
1-[(2R)-1-[2-(3-fluorophenyl)ethyl]piperazin-2-yl]ethanol
CID 23641142
4-[[[4-Fluoro-3-(trifluoromethyl)phenyl]methylamino]methyl]-1-methylpiperidin-4-ol
CID 84590178
4-(Aminomethyl)-1-phenethylpiperidin-4-ol
CID 90271
1-{1-[2-(4-Fluorophenyl)ethyl]piperidin-4-yl}methanamine
CID 8027502
4-Piperidinol, 4-ethynyl-1-phenethyl-
CID 3022004
4-[(3-Fluorophenyl)methyl]piperidin-4-ol
CID 10656016
4-[(4-Fluorophenyl)methyl]piperidin-4-ol hydrochloride
CID 70240549
1-Ethyl-3-[[(2-fluorophenyl)methylamino]methyl]piperidin-3-ol
CID 56730047
1-Benzyl-4-(difluoromethyl)piperidin-4-ol
CID 80604998

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol?
The IUPAC name of 4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol (CID 82298197) is 4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol.
What is the SMILES notation for 4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol?
The canonical SMILES for 4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol is NCC1(O)CCN(CCc2ccccc2F)CC1.
What is the InChIKey of 4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol?
The InChIKey is SJRFOIKGOTYFFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2O/c15-13-4-2-1-3-12(13)5-8-17-9-6-14(18,11-16)7-10-17/h1-4,18H,5-11,16H2.
What are the key properties of 4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol?
4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol has a molecular weight of 252.33 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-1-[2-(2-fluorophenyl)ethyl]piperidin-4-ol is sourced from PubChem (CID 82298197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).