(R)-(4-bromophenyl)-pyridin-3-ylmethanamine

C12H11BrN2 — CID 42137795

IUPAC(R)-(4-bromophenyl)-pyridin-3-ylmethanamine
SMILESN[C@H](c1ccc(Br)cc1)c1cccnc1
InChIInChI=1S/C12H11BrN2/c13-11-5-3-9(4-6-11)12(14)10-2-1-7-15-8-10/h1-8,12H,14H2/t12-/m1/s1
InChIKeyRUXAKBAMHWCBPS-GFCCVEGCSA-N
MW263.14 g/mol
LogP2.89
Rot. Bonds2

About (R)-(4-bromophenyl)-pyridin-3-ylmethanamine

(R)-(4-bromophenyl)-pyridin-3-ylmethanamine (PubChem CID 42137795) has the molecular formula C12H11BrN2 and a molecular weight of 263.14 g/mol. Its IUPAC name is (R)-(4-bromophenyl)-pyridin-3-ylmethanamine.

Molecular Properties

Compound Name(R)-(4-bromophenyl)-pyridin-3-ylmethanamine
PubChem CID42137795
Molecular FormulaC12H11BrN2
Molecular Weight263.14 g/mol
Exact Mass262.01
IUPAC Name(R)-(4-bromophenyl)-pyridin-3-ylmethanamine
SMILESN[C@H](c1ccc(Br)cc1)c1cccnc1
InChIInChI=1S/C12H11BrN2/c13-11-5-3-9(4-6-11)12(14)10-2-1-7-15-8-10/h1-8,12H,14H2/t12-/m1/s1
InChIKeyRUXAKBAMHWCBPS-GFCCVEGCSA-N
XLogP2.89
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.14
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

phenyl(pyridin-3-yl)methanamine;hydrochloride
CID 23724449
(4-ethylphenyl)-pyridin-3-ylmethanamine;dihydrochloride
CID 117071668
4-(4-bromophenyl)-4-pyridin-3-ylbutan-2-amine
CID 70611529
(4-bromo-2-fluorophenyl)-pyridin-3-ylmethanamine
CID 114906176
ethane;pyridin-3-yl(pyrimidin-5-yl)methanamine
CID 145185117
[4-(2-methylpropyl)phenyl]-pyridin-3-ylmethanamine
CID 43198863
1-(4-bromophenyl)-N-[(1R)-1-pyridin-3-ylethyl]ethanamine
CID 79690838
(1S,2S)-1,2-dipyridin-3-ylethane-1,2-diamine
CID 30682697
(2,6-dichlorophenyl)-pyridin-3-ylmethanamine
CID 115799088
3-(4-bromophenoxy)-1-pyridin-3-ylpropan-1-amine
CID 54971173
pyridin-3-yl-[4-(2,2,2-trifluoroethoxy)phenyl]methanamine
CID 70392473
(3-fluoro-4-methylphenyl)-pyridin-3-ylmethanamine
CID 60923509

Frequently Asked Questions

What is the IUPAC name of (R)-(4-bromophenyl)-pyridin-3-ylmethanamine?
The IUPAC name of (R)-(4-bromophenyl)-pyridin-3-ylmethanamine (CID 42137795) is (R)-(4-bromophenyl)-pyridin-3-ylmethanamine.
What is the SMILES notation for (R)-(4-bromophenyl)-pyridin-3-ylmethanamine?
The canonical SMILES for (R)-(4-bromophenyl)-pyridin-3-ylmethanamine is N[C@H](c1ccc(Br)cc1)c1cccnc1.
What is the InChIKey of (R)-(4-bromophenyl)-pyridin-3-ylmethanamine?
The InChIKey is RUXAKBAMHWCBPS-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H11BrN2/c13-11-5-3-9(4-6-11)12(14)10-2-1-7-15-8-10/h1-8,12H,14H2/t12-/m1/s1.
What are the key properties of (R)-(4-bromophenyl)-pyridin-3-ylmethanamine?
(R)-(4-bromophenyl)-pyridin-3-ylmethanamine has a molecular weight of 263.14 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(4-bromophenyl)-pyridin-3-ylmethanamine is sourced from PubChem (CID 42137795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).