(R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine

C9H11BrN2 — CID 124518533

IUPAC(R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine
SMILESN[C@@H](c1cccnc1Br)C1CC1
InChIInChI=1S/C9H11BrN2/c10-9-7(2-1-5-12-9)8(11)6-3-4-6/h1-2,5-6,8H,3-4,11H2/t8-/m1/s1
InChIKeyVMEPWHBKQFRJKX-MRVPVSSYSA-N
MW227.10 g/mol
LogP2.25
Rot. Bonds2

About (R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine

(R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine (PubChem CID 124518533) has the molecular formula C9H11BrN2 and a molecular weight of 227.10 g/mol. Its IUPAC name is (R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine.

Molecular Properties

Compound Name(R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine
PubChem CID124518533
Molecular FormulaC9H11BrN2
Molecular Weight227.10 g/mol
Exact Mass226.01
IUPAC Name(R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine
SMILESN[C@@H](c1cccnc1Br)C1CC1
InChIInChI=1S/C9H11BrN2/c10-9-7(2-1-5-12-9)8(11)6-3-4-6/h1-2,5-6,8H,3-4,11H2/t8-/m1/s1
InChIKeyVMEPWHBKQFRJKX-MRVPVSSYSA-N
XLogP2.25
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.10
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

(1R)-1-(2-bromo-3-pyridinyl)-2-cyclopropylethanamine
CID 130699495
(R)-(2-chloro-3-pyridinyl)-cyclobutylmethanamine
CID 131061254
cyclopropyl-(2-ethoxy-3-pyridinyl)methanamine
CID 55296468
(2-bromo-3-iodophenyl)-cyclopropylmethanamine
CID 130043777
(R)-cyclopentyl-(2-fluoro-3-pyridinyl)methanamine
CID 130632989
3-[(R)-amino(cyclohexyl)methyl]pyridin-2-amine;hydrochloride
CID 171211332
(1S)-1-(2-bromo-3-pyridinyl)-2-fluoroethanamine
CID 130642809
(1R)-1-(2-bromo-3-pyridinyl)-3,3-difluoropropan-1-amine
CID 171313620
(1S)-1-(2-bromo-3-pyridinyl)-3,3-difluoropropan-1-amine
CID 171312989
(1S)-1-(2-bromo-3-pyridinyl)-2,2,2-trifluoroethanamine
CID 97290353
(2S)-2-amino-2-(2-bromo-3-pyridinyl)ethanol
CID 130865139
2-bromo-3-propan-2-ylpyridine
CID 23436869

Frequently Asked Questions

What is the IUPAC name of (R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine?
The IUPAC name of (R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine (CID 124518533) is (R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine.
What is the SMILES notation for (R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine?
The canonical SMILES for (R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine is N[C@@H](c1cccnc1Br)C1CC1.
What is the InChIKey of (R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine?
The InChIKey is VMEPWHBKQFRJKX-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H11BrN2/c10-9-7(2-1-5-12-9)8(11)6-3-4-6/h1-2,5-6,8H,3-4,11H2/t8-/m1/s1.
What are the key properties of (R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine?
(R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine has a molecular weight of 227.10 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(2-bromo-3-pyridinyl)-cyclopropylmethanamine is sourced from PubChem (CID 124518533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).