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

C15H23FN2O — CID 62977944

IUPAC4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol
SMILESCC(c1ccccc1F)N(C)CC1(O)CCNCC1
InChIInChI=1S/C15H23FN2O/c1-12(13-5-3-4-6-14(13)16)18(2)11-15(19)7-9-17-10-8-15/h3-6,12,17,19H,7-11H2,1-2H3
InChIKeyUAWJXMNIAVNDTH-UHFFFAOYSA-N
MW266.36 g/mol
LogP1.93
Rot. Bonds4

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

4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol (PubChem CID 62977944) has the molecular formula C15H23FN2O and a molecular weight of 266.36 g/mol. Its IUPAC name is 4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol.

Molecular Properties

Compound Name4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol
PubChem CID62977944
Molecular FormulaC15H23FN2O
Molecular Weight266.36 g/mol
Exact Mass266.18
IUPAC Name4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol
SMILESCC(c1ccccc1F)N(C)CC1(O)CCNCC1
InChIInChI=1S/C15H23FN2O/c1-12(13-5-3-4-6-14(13)16)18(2)11-15(19)7-9-17-10-8-15/h3-6,12,17,19H,7-11H2,1-2H3
InChIKeyUAWJXMNIAVNDTH-UHFFFAOYSA-N
XLogP1.93
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[1-(2-chlorophenyl)ethyl-methylamino]methyl]piperidin-4-ol
CID 62978113
3-[1-(2-fluorophenyl)ethyl-methylamino]-1-piperazin-1-ylpropan-1-one
CID 62977945
1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine
CID 62984190
N-[[1-(bromomethyl)cyclohexyl]methyl]-1-(2-fluorophenyl)-N-methylethanamine
CID 65006736
2-[1-(2-fluorophenyl)ethyl-methylamino]-1-piperazin-1-ylethanone
CID 61018397
1-[1-(2-fluorophenyl)ethyl-methylamino]-2-methylpropan-2-ol
CID 62980625
2-[1-(2-fluorophenyl)ethyl-methylamino]acetic acid
CID 62979540
4-[[methyl(1-thiophen-2-ylpropan-2-yl)amino]methyl]piperidin-4-ol
CID 79476515
1-[1-(2-fluorophenyl)ethyl-methylamino]-3,3-dimethylbutan-2-ol
CID 55139894
4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]-4-methyloxolan-3-amine
CID 66263079
1-N-[1-(2-fluorophenyl)ethyl]-1-N,2,2-trimethylbutane-1,3-diamine
CID 66452582
hydrazinyl 3-[1-(2-fluorophenyl)ethyl-methylamino]propanoate
CID 66338215

Frequently Asked Questions

What is the IUPAC name of 4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol?
The IUPAC name of 4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol (CID 62977944) is 4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol.
What is the SMILES notation for 4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol?
The canonical SMILES for 4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol is CC(c1ccccc1F)N(C)CC1(O)CCNCC1.
What is the InChIKey of 4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol?
The InChIKey is UAWJXMNIAVNDTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O/c1-12(13-5-3-4-6-14(13)16)18(2)11-15(19)7-9-17-10-8-15/h3-6,12,17,19H,7-11H2,1-2H3.
What are the key properties of 4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol?
4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol has a molecular weight of 266.36 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol is sourced from PubChem (CID 62977944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).