1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine

C16H25FN2 — CID 62984190

IUPAC1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine
SMILESCC(c1ccccc1F)N(C)CCC1CCNCC1
InChIInChI=1S/C16H25FN2/c1-13(15-5-3-4-6-16(15)17)19(2)12-9-14-7-10-18-11-8-14/h3-6,13-14,18H,7-12H2,1-2H3
InChIKeyGJGNQEWZQCUOQT-UHFFFAOYSA-N
MW264.39 g/mol
LogP3.21
Rot. Bonds5

About 1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine

1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine (PubChem CID 62984190) has the molecular formula C16H25FN2 and a molecular weight of 264.39 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine
PubChem CID62984190
Molecular FormulaC16H25FN2
Molecular Weight264.39 g/mol
Exact Mass264.20
IUPAC Name1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine
SMILESCC(c1ccccc1F)N(C)CCC1CCNCC1
InChIInChI=1S/C16H25FN2/c1-13(15-5-3-4-6-16(15)17)19(2)12-9-14-7-10-18-11-8-14/h3-6,13-14,18H,7-12H2,1-2H3
InChIKeyGJGNQEWZQCUOQT-UHFFFAOYSA-N
XLogP3.21
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-fluorophenyl)-N-methyl-N-(piperidin-4-ylmethyl)propan-1-amine
CID 112679240
3-[1-(2-fluorophenyl)ethyl-methylamino]-1-piperazin-1-ylpropan-1-one
CID 62977945
4-[[1-(2-fluorophenyl)ethyl-methylamino]methyl]piperidin-4-ol
CID 62977944
N-cyclopropyl-N'-[1-(2-fluorophenyl)ethyl]-N'-methylpropane-1,3-diamine
CID 62986091
2-cyclopropyl-1-N-[1-(2-fluorophenyl)ethyl]-1-N-methylpropane-1,2-diamine
CID 62985957
N'-[1-(2-fluorophenyl)ethyl]-N'-methylhexane-1,6-diamine
CID 62985248
5-[1-(2-fluorophenyl)ethyl-methylamino]-2,2-dimethylpentanenitrile
CID 65257421
2-[methyl(2-piperidin-4-ylethyl)amino]-N-phenylpropanamide
CID 66273436
2-[1-(2-fluorophenyl)ethyl-methylamino]-1-piperazin-1-ylethanone
CID 61018397
2-fluoro-6-hydroxy-N-methyl-N-(2-piperidin-4-ylethyl)benzamide
CID 107014722
1-[1-(2-fluorophenyl)ethyl-methylamino]-2-methylpropan-2-ol
CID 62980625
1-N-[1-(2-fluorophenyl)ethyl]-1-N,2,2-trimethylbutane-1,3-diamine
CID 66452582

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine?
The IUPAC name of 1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine (CID 62984190) is 1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine.
What is the SMILES notation for 1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine?
The canonical SMILES for 1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine is CC(c1ccccc1F)N(C)CCC1CCNCC1.
What is the InChIKey of 1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine?
The InChIKey is GJGNQEWZQCUOQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2/c1-13(15-5-3-4-6-16(15)17)19(2)12-9-14-7-10-18-11-8-14/h3-6,13-14,18H,7-12H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine?
1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine has a molecular weight of 264.39 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-methyl-N-(2-piperidin-4-ylethyl)ethanamine is sourced from PubChem (CID 62984190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).