(1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine

C8H15FN2 — CID 143715110

IUPAC(1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine
SMILESCN1C[C@H]2CC(CF)[C@@]2(N)C1
InChIInChI=1S/C8H15FN2/c1-11-4-7-2-6(3-9)8(7,10)5-11/h6-7H,2-5,10H2,1H3/t6?,7-,8+/m1/s1
InChIKeyIZRWMJQVPHIROU-VVXQKDJTSA-N
MW158.22 g/mol
LogP0.23
Rot. Bonds1

About (1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine

(1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine (PubChem CID 143715110) has the molecular formula C8H15FN2 and a molecular weight of 158.22 g/mol. Its IUPAC name is (1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine.

Molecular Properties

Compound Name(1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine
PubChem CID143715110
Molecular FormulaC8H15FN2
Molecular Weight158.22 g/mol
Exact Mass158.12
IUPAC Name(1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine
SMILESCN1C[C@H]2CC(CF)[C@@]2(N)C1
InChIInChI=1S/C8H15FN2/c1-11-4-7-2-6(3-9)8(7,10)5-11/h6-7H,2-5,10H2,1H3/t6?,7-,8+/m1/s1
InChIKeyIZRWMJQVPHIROU-VVXQKDJTSA-N
XLogP0.23
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.22
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R,5R,7S)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine
CID 69172507
(1S,5R,6S)-6-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine
CID 69172512
(1S,5R,6S)-6-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine
CID 69172525
(1S,5R)-6,6-difluoro-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine
CID 69172528
(1S,5R,6R)-6-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine
CID 69172530
(1S,5R,6R)-6-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine
CID 69172533
(1R,5S)-5-fluoro-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine
CID 69172534
(1S,5R,6S)-6-(fluoromethyl)-3-azabicyclo[3.2.0]heptan-1-amine
CID 89257349
(1S,5R,6R)-6-(fluoromethyl)-3-azabicyclo[3.2.0]heptan-1-amine
CID 90985743
(1S,5S,6R)-6-fluoro-3-azabicyclo[3.2.0]heptan-1-amine
CID 91483246
(1R,5S)-5-fluoro-3-azabicyclo[3.2.0]heptan-1-amine
CID 123527348
(1S,5S,6S)-6-fluoro-3-azabicyclo[3.2.0]heptan-1-amine
CID 123850624

Frequently Asked Questions

What is the IUPAC name of (1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine?
The IUPAC name of (1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine (CID 143715110) is (1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine.
What is the SMILES notation for (1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine?
The canonical SMILES for (1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine is CN1C[C@H]2CC(CF)[C@@]2(N)C1.
What is the InChIKey of (1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine?
The InChIKey is IZRWMJQVPHIROU-VVXQKDJTSA-N. The full InChI is InChI=1S/C8H15FN2/c1-11-4-7-2-6(3-9)8(7,10)5-11/h6-7H,2-5,10H2,1H3/t6?,7-,8+/m1/s1.
What are the key properties of (1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine?
(1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine has a molecular weight of 158.22 g/mol, XLogP of 0.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,5R)-7-(fluoromethyl)-3-methyl-3-azabicyclo[3.2.0]heptan-1-amine is sourced from PubChem (CID 143715110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).