1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine

C23H28F2N2 — CID 143371492

IUPAC1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine
SMILESCN(CC1CC2CCC(C1)N2C)C(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C23H28F2N2/c1-26(15-16-13-21-11-12-22(14-16)27(21)2)23(17-3-7-19(24)8-4-17)18-5-9-20(25)10-6-18/h3-10,16,21-23H,11-15H2,1-2H3
InChIKeyWMXCJAOHMCIJMM-UHFFFAOYSA-N
MW370.49 g/mol
LogP4.86
Rot. Bonds5

About 1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine

1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine (PubChem CID 143371492) has the molecular formula C23H28F2N2 and a molecular weight of 370.49 g/mol. Its IUPAC name is 1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine.

Molecular Properties

Compound Name1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine
PubChem CID143371492
Molecular FormulaC23H28F2N2
Molecular Weight370.49 g/mol
Exact Mass370.22
IUPAC Name1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine
SMILESCN(CC1CC2CCC(C1)N2C)C(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C23H28F2N2/c1-26(15-16-13-21-11-12-22(14-16)27(21)2)23(17-3-7-19(24)8-4-17)18-5-9-20(25)10-6-18/h3-10,16,21-23H,11-15H2,1-2H3
InChIKeyWMXCJAOHMCIJMM-UHFFFAOYSA-N
XLogP4.86
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.49
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine with MolForge

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Related Compounds

1-(4-fluorophenyl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]ethanamine
CID 61013394
1-(4-fluorophenyl)-2-N-methyl-2-N-[(1-methylpyrrolidin-3-yl)methyl]propane-1,2-diamine
CID 107521169
1-(4-fluorophenyl)-N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine
CID 112681196
N-(cyclopropylmethyl)-1-(4-fluorophenyl)-N-methylethane-1,2-diamine
CID 60985647
(1S,5R)-3-[bis(4-fluorophenyl)methoxy]-8-methyl-8-azabicyclo[3.2.1]octane;hydrochloride
CID 24978533
1-N-(cyclopropylmethyl)-1-(4-fluorophenyl)-1-N-methylpropane-1,2-diamine
CID 55016538
N-[1-(4-fluorophenyl)-2-methylpropyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 43685485
1-(4-fluorophenyl)-N-methyl-N-(piperidin-4-ylmethyl)propan-1-amine
CID 79707251
1-(4-fluorophenyl)-N,2-dimethyl-N-(piperidin-3-ylmethyl)propan-1-amine
CID 120849617
1-(3,4-difluorophenyl)-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]ethanamine
CID 61013117
1-(4-fluorophenyl)-1-N-methyl-1-N-(oxan-4-ylmethyl)propane-1,2-diamine
CID 63727122
(2R)-1-[4-[[[(2S)-2-(4-fluorophenyl)-2-hydroxyethyl]-methylamino]methyl]piperidin-1-yl]propan-2-ol
CID 100840896

Frequently Asked Questions

What is the IUPAC name of 1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine?
The IUPAC name of 1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine (CID 143371492) is 1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine.
What is the SMILES notation for 1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine?
The canonical SMILES for 1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine is CN(CC1CC2CCC(C1)N2C)C(c1ccc(F)cc1)c1ccc(F)cc1.
What is the InChIKey of 1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine?
The InChIKey is WMXCJAOHMCIJMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28F2N2/c1-26(15-16-13-21-11-12-22(14-16)27(21)2)23(17-3-7-19(24)8-4-17)18-5-9-20(25)10-6-18/h3-10,16,21-23H,11-15H2,1-2H3.
What are the key properties of 1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine?
1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine has a molecular weight of 370.49 g/mol, XLogP of 4.86, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-bis(4-fluorophenyl)-N-methyl-N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]methanamine is sourced from PubChem (CID 143371492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).