N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine

C13H17FN2 — CID 105476083

IUPACN-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESFc1ccccc1NC1CC2CCC(C1)N2
InChIInChI=1S/C13H17FN2/c14-12-3-1-2-4-13(12)16-11-7-9-5-6-10(8-11)15-9/h1-4,9-11,15-16H,5-8H2
InChIKeyNBXGWZPXFGLYFD-UHFFFAOYSA-N
MW220.29 g/mol
LogP2.52
Rot. Bonds2

About N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine

N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 105476083) has the molecular formula C13H17FN2 and a molecular weight of 220.29 g/mol. Its IUPAC name is N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound NameN-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID105476083
Molecular FormulaC13H17FN2
Molecular Weight220.29 g/mol
Exact Mass220.14
IUPAC NameN-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine
SMILESFc1ccccc1NC1CC2CCC(C1)N2
InChIInChI=1S/C13H17FN2/c14-12-3-1-2-4-13(12)16-11-7-9-5-6-10(8-11)15-9/h1-4,9-11,15-16H,5-8H2
InChIKeyNBXGWZPXFGLYFD-UHFFFAOYSA-N
XLogP2.52
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-N-(3-phenylcyclobutyl)aniline
CID 43632160
2-(8-azabicyclo[3.2.1]octan-3-ylamino)benzenesulfonamide
CID 61230839
N-[3-(4-chlorophenyl)cyclobutyl]-2-fluoroaniline
CID 43633620
N-(2-fluorophenyl)oxan-4-amine
CID 43608428
N-(3-cyclopropylcyclohexyl)-2-fluoroaniline
CID 64595816
1-N-(2-fluorophenyl)cyclohexane-1,3-diamine
CID 79458440
N-(2-fluorophenyl)oxolan-3-amine
CID 63332099
2-(8-azabicyclo[3.2.1]octan-3-ylamino)-5-fluorobenzonitrile
CID 63672782
N-(3-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 62252990
2-(8-azabicyclo[3.2.1]octan-3-ylamino)-6-bromobenzamide
CID 114884728
4-(8-azabicyclo[3.2.1]octan-3-ylamino)-2H-phthalazin-1-one
CID 11687651
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-(2-fluorophenyl)-2-methylpropanamide
CID 119459069

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine (CID 105476083) is N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine is Fc1ccccc1NC1CC2CCC(C1)N2.
What is the InChIKey of N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is NBXGWZPXFGLYFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2/c14-12-3-1-2-4-13(12)16-11-7-9-5-6-10(8-11)15-9/h1-4,9-11,15-16H,5-8H2.
What are the key properties of N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine?
N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 220.29 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 105476083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).