1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine

C15H22F2N2 — CID 106622772

IUPAC1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
SMILESCC(c1ccc(F)cc1F)N(C)CC1CCCCN1
InChIInChI=1S/C15H22F2N2/c1-11(14-7-6-12(16)9-15(14)17)19(2)10-13-5-3-4-8-18-13/h6-7,9,11,13,18H,3-5,8,10H2,1-2H3
InChIKeyFNQXYPQVZVUWJB-UHFFFAOYSA-N
MW268.35 g/mol
LogP3.10
Rot. Bonds4

About 1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine

1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine (PubChem CID 106622772) has the molecular formula C15H22F2N2 and a molecular weight of 268.35 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
PubChem CID106622772
Molecular FormulaC15H22F2N2
Molecular Weight268.35 g/mol
Exact Mass268.18
IUPAC Name1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
SMILESCC(c1ccc(F)cc1F)N(C)CC1CCCCN1
InChIInChI=1S/C15H22F2N2/c1-11(14-7-6-12(16)9-15(14)17)19(2)10-13-5-3-4-8-18-13/h6-7,9,11,13,18H,3-5,8,10H2,1-2H3
InChIKeyFNQXYPQVZVUWJB-UHFFFAOYSA-N
XLogP3.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.35
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2-chloro-4-fluorophenyl)ethyl]-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106622086
3-fluoro-4-[1-[piperidin-2-ylmethyl(propan-2-yl)amino]ethyl]phenol
CID 107720853
1-(2-methoxyphenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106623052
1-(4-bromo-2-fluorophenyl)-N-ethyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106622422
1-(2-chlorophenyl)-N-methyl-N-[[(2R)-pyrrolidin-2-yl]methyl]ethanamine
CID 102819503
N-methyl-N-(piperidin-2-ylmethyl)-1-pyridin-4-ylethanamine
CID 106623108
(1S)-1-(furan-2-yl)-N-methyl-N-[[(2S)-piperidin-2-yl]methyl]ethanamine
CID 97162149
1-(1,3-benzodioxol-5-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106622998
1-(4-chlorophenyl)-N-methyl-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 62980654
1-(2,4-difluorophenyl)-2-pyrrolidin-2-ylethanol
CID 81466022
N-[(2-chloro-5-fluorophenyl)methyl]-N-methyl-1-piperidin-2-ylmethanamine
CID 106635442
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine
CID 106622995

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine?
The IUPAC name of 1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine (CID 106622772) is 1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine.
What is the SMILES notation for 1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine?
The canonical SMILES for 1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine is CC(c1ccc(F)cc1F)N(C)CC1CCCCN1.
What is the InChIKey of 1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine?
The InChIKey is FNQXYPQVZVUWJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22F2N2/c1-11(14-7-6-12(16)9-15(14)17)19(2)10-13-5-3-4-8-18-13/h6-7,9,11,13,18H,3-5,8,10H2,1-2H3.
What are the key properties of 1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine?
1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine has a molecular weight of 268.35 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-N-methyl-N-(piperidin-2-ylmethyl)ethanamine is sourced from PubChem (CID 106622772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).