N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine

C16H25FN2 — CID 62332170

IUPACN-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine
SMILESCCNCc1cc(F)ccc1N1CCC(C)CC1C
InChIInChI=1S/C16H25FN2/c1-4-18-11-14-10-15(17)5-6-16(14)19-8-7-12(2)9-13(19)3/h5-6,10,12-13,18H,4,7-9,11H2,1-3H3
InChIKeyIUUXMYJFUKASLH-UHFFFAOYSA-N
MW264.39 g/mol
LogP3.56
Rot. Bonds4

About N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine

N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine (PubChem CID 62332170) has the molecular formula C16H25FN2 and a molecular weight of 264.39 g/mol. Its IUPAC name is N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine
PubChem CID62332170
Molecular FormulaC16H25FN2
Molecular Weight264.39 g/mol
Exact Mass264.20
IUPAC NameN-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine
SMILESCCNCc1cc(F)ccc1N1CCC(C)CC1C
InChIInChI=1S/C16H25FN2/c1-4-18-11-14-10-15(17)5-6-16(14)19-8-7-12(2)9-13(19)3/h5-6,10,12-13,18H,4,7-9,11H2,1-3H3
InChIKeyIUUXMYJFUKASLH-UHFFFAOYSA-N
XLogP3.56
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methanamine
CID 55062001
N-[[4-chloro-2-(2,4-dimethylpiperidin-1-yl)phenyl]methyl]ethanamine
CID 114850627
N-[1-[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]ethyl]propan-1-amine
CID 63534019
N-[[2-[4-(cyclopropylmethyl)piperazin-1-yl]-5-fluorophenyl]methyl]ethanamine
CID 61445256
N-[[4-bromo-2-(2,4-dimethylpiperidin-1-yl)phenyl]methyl]propan-1-amine
CID 63551604
N-[[5-chloro-2-(2-methylpiperidin-1-yl)phenyl]methyl]ethanamine
CID 114847259
N-[(2,5-difluorophenyl)methyl]ethanamine
CID 43163700
N-[[5-fluoro-2-(2-methylpiperidin-1-yl)phenyl]methyl]-2-methylpropan-2-amine
CID 63059252
N-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-fluorophenyl]methyl]ethanamine
CID 43313766
N-[[4-fluoro-2-(4-methylpiperidin-1-yl)sulfonylphenyl]methyl]ethanamine
CID 102920201
N-[[2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-5-fluorophenyl]methyl]ethanamine
CID 79916053
N-[[2-(3-cyclopropylpyrazol-1-yl)-5-fluorophenyl]methyl]ethanamine
CID 62487619

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine?
The IUPAC name of N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine (CID 62332170) is N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine?
The canonical SMILES for N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine is CCNCc1cc(F)ccc1N1CCC(C)CC1C.
What is the InChIKey of N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine?
The InChIKey is IUUXMYJFUKASLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2/c1-4-18-11-14-10-15(17)5-6-16(14)19-8-7-12(2)9-13(19)3/h5-6,10,12-13,18H,4,7-9,11H2,1-3H3.
What are the key properties of N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine?
N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine has a molecular weight of 264.39 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2,4-dimethylpiperidin-1-yl)-5-fluorophenyl]methyl]ethanamine is sourced from PubChem (CID 62332170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).