1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol

C15H23FN2O — CID 95471751

IUPAC1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol
SMILESCNCC1(O)CCN(CCc2cccc(F)c2)CC1
InChIInChI=1S/C15H23FN2O/c1-17-12-15(19)6-9-18(10-7-15)8-5-13-3-2-4-14(16)11-13/h2-4,11,17,19H,5-10,12H2,1H3
InChIKeyZZXZMSMGUFGENX-UHFFFAOYSA-N
MW266.36 g/mol
LogP1.41
Rot. Bonds5

About 1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol

1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol (PubChem CID 95471751) has the molecular formula C15H23FN2O and a molecular weight of 266.36 g/mol. Its IUPAC name is 1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol.

Molecular Properties

Compound Name1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol
PubChem CID95471751
Molecular FormulaC15H23FN2O
Molecular Weight266.36 g/mol
Exact Mass266.18
IUPAC Name1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol
SMILESCNCC1(O)CCN(CCc2cccc(F)c2)CC1
InChIInChI=1S/C15H23FN2O/c1-17-12-15(19)6-9-18(10-7-15)8-5-13-3-2-4-14(16)11-13/h2-4,11,17,19H,5-10,12H2,1H3
InChIKeyZZXZMSMGUFGENX-UHFFFAOYSA-N
XLogP1.41
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-hydroxy-1-(2-phenylethyl)piperidin-4-yl]methyl]acetamide
CID 165352141
4-[2-(3-fluorophenyl)ethyl]piperazine-2,6-dione
CID 63789963
1-[(2-fluorophenyl)methyl]-4-(methylaminomethyl)piperidin-4-ol
CID 39355997
1-[2-(3-fluorophenyl)ethyl]-N-propylpiperidin-4-amine
CID 43566257
4-ethyl-9-[2-(3-fluorophenyl)ethyl]-2,2-dimethyl-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 118561108
N-methyl-1-[3-methyl-1-(2-phenylethyl)pyrrolidin-3-yl]methanamine
CID 106318668
2-(3-fluorophenyl)-N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]ethanamine
CID 115244944
1-(2,6-dichlorophenyl)-4-[2-(3-fluorophenyl)ethyl]piperazine
CID 167760406
4-[(benzylamino)methyl]-1-[2-(5-fluoro-1H-indol-3-yl)ethyl]piperidin-4-ol
CID 10407490
N-[2-(3-fluorophenyl)ethyl]-1-(2-phenylethyl)piperidin-4-amine
CID 119164826
1-[2-(3-fluorophenyl)ethyl]-3-(methylamino)pyrrolidin-2-one
CID 54972964
4-(methylaminomethyl)-1-pentylpiperidin-4-ol
CID 95441823

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol?
The IUPAC name of 1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol (CID 95471751) is 1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol.
What is the SMILES notation for 1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol?
The canonical SMILES for 1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol is CNCC1(O)CCN(CCc2cccc(F)c2)CC1.
What is the InChIKey of 1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol?
The InChIKey is ZZXZMSMGUFGENX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2O/c1-17-12-15(19)6-9-18(10-7-15)8-5-13-3-2-4-14(16)11-13/h2-4,11,17,19H,5-10,12H2,1H3.
What are the key properties of 1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol?
1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol has a molecular weight of 266.36 g/mol, XLogP of 1.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-fluorophenyl)ethyl]-4-(methylaminomethyl)piperidin-4-ol is sourced from PubChem (CID 95471751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).