[(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine

C10H11BrFN — CID 94556792

IUPAC[(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine
SMILESNC[C@@H]1C[C@H]1c1cc(Br)ccc1F
InChIInChI=1S/C10H11BrFN/c11-7-1-2-10(12)9(4-7)8-3-6(8)5-13/h1-2,4,6,8H,3,5,13H2/t6-,8+/m0/s1
InChIKeyDZYHUVOZGVDCPW-POYBYMJQSA-N
MW244.11 g/mol
LogP2.65
Rot. Bonds2

About [(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine

[(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine (PubChem CID 94556792) has the molecular formula C10H11BrFN and a molecular weight of 244.11 g/mol. Its IUPAC name is [(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine
PubChem CID94556792
Molecular FormulaC10H11BrFN
Molecular Weight244.11 g/mol
Exact Mass243.01
IUPAC Name[(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine
SMILESNC[C@@H]1C[C@H]1c1cc(Br)ccc1F
InChIInChI=1S/C10H11BrFN/c11-7-1-2-10(12)9(4-7)8-3-6(8)5-13/h1-2,4,6,8H,3,5,13H2/t6-,8+/m0/s1
InChIKeyDZYHUVOZGVDCPW-POYBYMJQSA-N
XLogP2.65
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.11
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[2-(5-bromo-2-fluorophenyl)-4,4-dimethylcyclohexyl]methanamine
CID 81011493
2-(5-bromo-2-fluorophenyl)cyclobutan-1-amine
CID 81014478
[(1R,2S)-2-(2,4-difluorophenyl)cyclopropyl]methanamine
CID 94556815
2-[4-(5-bromo-2-fluorophenyl)piperidin-1-yl]ethanamine
CID 116962876
[(1R,2R)-2-(3,4-difluorophenyl)cyclopropyl]methanamine
CID 94556780
[(1R,2S)-2-(2,4-dichlorophenyl)cyclopropyl]methanamine
CID 94557667
[2-(2,5-difluorophenyl)-4-methylcyclohexyl]methanamine
CID 81010421
[(1R,2R)-2-(2-bromophenyl)cyclopropyl]methanamine;hydrochloride
CID 44572752
[2-(4-fluoro-3-methylphenyl)cyclopropyl]methanamine
CID 62704549
[(1S,2S)-2-(2-chloro-4-fluorophenyl)cyclopropyl]methanamine;hydrochloride
CID 44572165
3-(5-bromo-2-fluorophenyl)-2-methylcyclopentan-1-ol
CID 79740139
[2-(2,5-difluorophenyl)-4-propan-2-ylcyclohexyl]methanamine
CID 81011940

Frequently Asked Questions

What is the IUPAC name of [(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine?
The IUPAC name of [(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine (CID 94556792) is [(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine.
What is the SMILES notation for [(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine?
The canonical SMILES for [(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine is NC[C@@H]1C[C@H]1c1cc(Br)ccc1F.
What is the InChIKey of [(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine?
The InChIKey is DZYHUVOZGVDCPW-POYBYMJQSA-N. The full InChI is InChI=1S/C10H11BrFN/c11-7-1-2-10(12)9(4-7)8-3-6(8)5-13/h1-2,4,6,8H,3,5,13H2/t6-,8+/m0/s1.
What are the key properties of [(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine?
[(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine has a molecular weight of 244.11 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R)-2-(5-bromo-2-fluorophenyl)cyclopropyl]methanamine is sourced from PubChem (CID 94556792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).