(R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine

C10H11BrFN — CID 97290671

IUPAC(R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine
SMILESN[C@@H](c1ccc(F)cc1Br)C1CC1
InChIInChI=1S/C10H11BrFN/c11-9-5-7(12)3-4-8(9)10(13)6-1-2-6/h3-6,10H,1-2,13H2/t10-/m1/s1
InChIKeySCVBHXZPPUNCMS-SNVBAGLBSA-N
MW244.11 g/mol
LogP3.00
Rot. Bonds2

About (R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine

(R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine (PubChem CID 97290671) has the molecular formula C10H11BrFN and a molecular weight of 244.11 g/mol. Its IUPAC name is (R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine.

Molecular Properties

Compound Name(R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine
PubChem CID97290671
Molecular FormulaC10H11BrFN
Molecular Weight244.11 g/mol
Exact Mass243.01
IUPAC Name(R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine
SMILESN[C@@H](c1ccc(F)cc1Br)C1CC1
InChIInChI=1S/C10H11BrFN/c11-9-5-7(12)3-4-8(9)10(13)6-1-2-6/h3-6,10H,1-2,13H2/t10-/m1/s1
InChIKeySCVBHXZPPUNCMS-SNVBAGLBSA-N
XLogP3.00
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 ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(R)-(2-bromo-4-fluorophenyl)-piperidin-4-ylmethanamine
CID 171314194
(2-bromo-5-fluorophenyl)-cyclopropylmethanamine
CID 71743656
(2-bromo-4-fluorophenyl)-(oxan-3-yl)methanamine
CID 107138851
(R)-cyclopropyl-[4-fluoro-2-(trifluoromethyl)phenyl]methanamine
CID 131415856
(2-bromo-4-methoxyphenyl)-cyclopropylmethanamine
CID 3340478
(S)-cyclopropyl-[4-fluoro-2-(trifluoromethyl)phenyl]methanamine
CID 131397243
(R)-(2-bromo-5-fluorophenyl)-piperidin-4-ylmethanamine
CID 171314252
(R)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine
CID 130968166
(2-bromo-4-chlorophenyl)-cyclobutylmethanamine
CID 103947074
2-[(R)-amino(cyclopropyl)methyl]-5-fluorobenzoic acid
CID 131869097
(S)-cyclopropyl-(4-fluoro-2-methoxyphenyl)methanamine;hydrochloride
CID 171224902
(S)-(2-bromo-4-fluoro-5-methylphenyl)-cyclopropylmethanamine
CID 131080956

Frequently Asked Questions

What is the IUPAC name of (R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine?
The IUPAC name of (R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine (CID 97290671) is (R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine.
What is the SMILES notation for (R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine?
The canonical SMILES for (R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine is N[C@@H](c1ccc(F)cc1Br)C1CC1.
What is the InChIKey of (R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine?
The InChIKey is SCVBHXZPPUNCMS-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H11BrFN/c11-9-5-7(12)3-4-8(9)10(13)6-1-2-6/h3-6,10H,1-2,13H2/t10-/m1/s1.
What are the key properties of (R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine?
(R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine has a molecular weight of 244.11 g/mol, XLogP of 3.00, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine is sourced from PubChem (CID 97290671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).