cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride

C15H15BrClN — CID 118483768

IUPACcis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride
SMILESCl.N[C@]1(c2ccccc2)C[C@@H]1c1ccc(Br)cc1
InChIInChI=1S/C15H14BrN.ClH/c16-13-8-6-11(7-9-13)14-10-15(14,17)12-4-2-1-3-5-12;/h1-9,14H,10,17H2;1H/t14-,15+;/m1./s1
InChIKeyUVALOZAVRJBQRJ-LIOBNPLQSA-N
MW324.65 g/mol
LogP4.21
Rot. Bonds2

About cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride

cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride (PubChem CID 118483768) has the molecular formula C15H15BrClN and a molecular weight of 324.65 g/mol. Its IUPAC name is cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride.

Molecular Properties

Compound Namecis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride
PubChem CID118483768
Molecular FormulaC15H15BrClN
Molecular Weight324.65 g/mol
Exact Mass323.01
IUPAC Namecis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride
SMILESCl.N[C@]1(c2ccccc2)C[C@@H]1c1ccc(Br)cc1
InChIInChI=1S/C15H14BrN.ClH/c16-13-8-6-11(7-9-13)14-10-15(14,17)12-4-2-1-3-5-12;/h1-9,14H,10,17H2;1H/t14-,15+;/m1./s1
InChIKeyUVALOZAVRJBQRJ-LIOBNPLQSA-N
XLogP4.21
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.65
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

rac-(1R,2S)-2-(4-bromophenyl)cyclopropan-1-amine hydrochloride
CID 56683886
2-(4-Bromophenyl)-2-phenylethanamine
CID 25139019
trans-(1R,2S)-1,2-diphenylcyclopropan-1-amine;hydrochloride
CID 90197685
trans-(1S,2R)-1,2-diphenylcyclopropan-1-amine;hydrochloride
CID 118483913
cis-(1S,2S)-1,2-diphenylcyclopropan-1-amine;hydrochloride
CID 118483914
2-(4-Bromophenyl)propan-2-amine
CID 23009116
Phenethylamine, p-bromo-alpha,alpha-dimethyl-, hydrochloride
CID 73838
1-(2-Bromophenyl)cyclopropanamine
CID 10921794
1-(4-Bromophenyl)cyclopropanamine
CID 18710195
1-[(1S,2S)-2-(4-bromophenyl)cyclopropyl]methanamine hydrochloride, trans
CID 44573001
cis-(1S,2R)-2-(2-bromophenyl)-1-ethylcyclopropan-1-amine;hydrochloride
CID 118730201
cis-(1S,2R)-2-(4-bromophenyl)-1-ethylcyclopropan-1-amine;hydrochloride
CID 118730217

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride?
The IUPAC name of cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride (CID 118483768) is cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride.
What is the SMILES notation for cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride?
The canonical SMILES for cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride is Cl.N[C@]1(c2ccccc2)C[C@@H]1c1ccc(Br)cc1.
What is the InChIKey of cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride?
The InChIKey is UVALOZAVRJBQRJ-LIOBNPLQSA-N. The full InChI is InChI=1S/C15H14BrN.ClH/c16-13-8-6-11(7-9-13)14-10-15(14,17)12-4-2-1-3-5-12;/h1-9,14H,10,17H2;1H/t14-,15+;/m1./s1.
What are the key properties of cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride?
cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride has a molecular weight of 324.65 g/mol, XLogP of 4.21, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2R)-2-(4-bromophenyl)-1-phenylcyclopropan-1-amine;hydrochloride is sourced from PubChem (CID 118483768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).