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

C10H11BrFN — CID 130968166

IUPAC(R)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine
SMILESN[C@@H](c1ccc(Br)cc1F)C1CC1
InChIInChI=1S/C10H11BrFN/c11-7-3-4-8(9(12)5-7)10(13)6-1-2-6/h3-6,10H,1-2,13H2/t10-/m1/s1
InChIKeyASDHVLXLULKEBE-SNVBAGLBSA-N
MW244.11 g/mol
LogP3.00
Rot. Bonds2

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

(R)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine (PubChem CID 130968166) has the molecular formula C10H11BrFN and a molecular weight of 244.11 g/mol. Its IUPAC name is (R)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine.

Molecular Properties

Compound Name(R)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine
PubChem CID130968166
Molecular FormulaC10H11BrFN
Molecular Weight244.11 g/mol
Exact Mass243.01
IUPAC Name(R)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine
SMILESN[C@@H](c1ccc(Br)cc1F)C1CC1
InChIInChI=1S/C10H11BrFN/c11-7-3-4-8(9(12)5-7)10(13)6-1-2-6/h3-6,10H,1-2,13H2/t10-/m1/s1
InChIKeyASDHVLXLULKEBE-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

(S)-(4-bromo-2-fluorophenyl)-(oxan-4-yl)methanamine;hydrochloride
CID 171239339
(5-bromo-2-fluorophenyl)-cyclopropylmethanamine;hydrochloride
CID 155487191
4-[amino-(5-bromo-2-fluorophenyl)methyl]cyclohexan-1-ol
CID 116941875
(S)-(4-bromo-2-chlorophenyl)-cyclopropylmethanamine
CID 130618338
4-[(S)-amino(cyclopropyl)methyl]-3-fluorophenol
CID 131064756
(5-bromo-2-fluorophenyl)-cyclohexylmethanamine
CID 79742739
(R)-(5-bromo-2-fluorophenyl)-cyclohexylmethanamine
CID 171200620
2-[(R)-amino(cyclopropyl)methyl]-4-bromo-6-fluorophenol
CID 130715689
(R)-(2-bromo-4-fluorophenyl)-cyclopropylmethanamine
CID 97290671
2-[(S)-amino(cyclopropyl)methyl]-4-bromo-6-fluorophenol;hydrochloride
CID 171253387
(5-bromo-2-fluorophenyl)-(4,4-difluorocyclohexyl)methanamine
CID 105167450
(S)-(4-bromo-2,6-difluorophenyl)-cyclopropylmethanamine;hydrochloride
CID 171226288

Frequently Asked Questions

What is the IUPAC name of (R)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine?
The IUPAC name of (R)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine (CID 130968166) is (R)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine.
What is the SMILES notation for (R)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine?
The canonical SMILES for (R)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine is N[C@@H](c1ccc(Br)cc1F)C1CC1.
What is the InChIKey of (R)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine?
The InChIKey is ASDHVLXLULKEBE-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H11BrFN/c11-7-3-4-8(9(12)5-7)10(13)6-1-2-6/h3-6,10H,1-2,13H2/t10-/m1/s1.
What are the key properties of (R)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine?
(R)-(4-bromo-2-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)-(4-bromo-2-fluorophenyl)-cyclopropylmethanamine is sourced from PubChem (CID 130968166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).