N-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine

C16H20FN — CID 43503186

IUPACN-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine
SMILESFc1ccc(NC2CC3CC2C2CCCC32)cc1
InChIInChI=1S/C16H20FN/c17-11-4-6-12(7-5-11)18-16-9-10-8-15(16)14-3-1-2-13(10)14/h4-7,10,13-16,18H,1-3,8-9H2
InChIKeyRADSNOLQFIYAKB-UHFFFAOYSA-N
MW245.34 g/mol
LogP4.06
Rot. Bonds2

About N-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine

N-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine (PubChem CID 43503186) has the molecular formula C16H20FN and a molecular weight of 245.34 g/mol. Its IUPAC name is N-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine.

Molecular Properties

Compound NameN-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine
PubChem CID43503186
Molecular FormulaC16H20FN
Molecular Weight245.34 g/mol
Exact Mass245.16
IUPAC NameN-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine
SMILESFc1ccc(NC2CC3CC2C2CCCC32)cc1
InChIInChI=1S/C16H20FN/c17-11-4-6-12(7-5-11)18-16-9-10-8-15(16)14-3-1-2-13(10)14/h4-7,10,13-16,18H,1-3,8-9H2
InChIKeyRADSNOLQFIYAKB-UHFFFAOYSA-N
XLogP4.06
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.34
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-Fluorophenyl)-3-(8-tricyclo[5.2.1.02,6]dec-4-enyl)thiourea
CID 2803577
4-[[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]methyl]-N,N-dimethylaniline;hydrochloride
CID 2967205
(1S,4S)-1,7,7-Trimethyl-N-phenylbicyclo[2.2.1]heptan-2-aminium chloride
CID 16682066
9-Phenyl-9-azatetracyclo[5.3.1.02,6.08,10]undecane
CID 258561
1,7,7-trimethyl-N-phenylbicyclo[2.2.1]heptan-2-amine
CID 3787978
N-[2-(2-fluorophenyl)cyclopentyl]aniline
CID 164669789
N-Phenylbicyclo(2.2.1)heptan-2-amine
CID 12466395
N-(2-bicyclo[2.2.1]heptanylmethyl)aniline
CID 15638300
(1rs,2rs,4rs)-1,7,7-trimethyl-N-(4-methylphenyl)bicyclo[2.2.1]heptan-2-amine
CID 63420487
(1-Bicyclo[2.2.1]hept-2-ylethyl)[4-(dimethylamino)benzyl]amine hydrochloride
CID 2967206
(2S,6R,8R)-N-[(3-fluorophenyl)methyl]tricyclo[5.2.1.02,6]dec-3-en-8-amine
CID 9943079
(2R,6R,8R)-N-[(3-fluorophenyl)methyl]tricyclo[5.2.1.02,6]dec-4-en-8-amine
CID 9943080

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine?
The IUPAC name of N-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine (CID 43503186) is N-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine.
What is the SMILES notation for N-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine?
The canonical SMILES for N-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine is Fc1ccc(NC2CC3CC2C2CCCC32)cc1.
What is the InChIKey of N-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine?
The InChIKey is RADSNOLQFIYAKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN/c17-11-4-6-12(7-5-11)18-16-9-10-8-15(16)14-3-1-2-13(10)14/h4-7,10,13-16,18H,1-3,8-9H2.
What are the key properties of N-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine?
N-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine has a molecular weight of 245.34 g/mol, XLogP of 4.06, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)tricyclo[5.2.1.02,6]decan-8-amine is sourced from PubChem (CID 43503186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).