[3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine

C10H12BrClN2O — CID 114838257

IUPAC[3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine
SMILESNCC1CC(Oc2ncc(Cl)cc2Br)C1
InChIInChI=1S/C10H12BrClN2O/c11-9-3-7(12)5-14-10(9)15-8-1-6(2-8)4-13/h3,5-6,8H,1-2,4,13H2
InChIKeyHWYGGSFSCTZCRR-UHFFFAOYSA-N
MW291.58 g/mol
LogP2.61
Rot. Bonds3

About [3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine

[3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine (PubChem CID 114838257) has the molecular formula C10H12BrClN2O and a molecular weight of 291.58 g/mol. Its IUPAC name is [3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine.

Molecular Properties

Compound Name[3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine
PubChem CID114838257
Molecular FormulaC10H12BrClN2O
Molecular Weight291.58 g/mol
Exact Mass289.98
IUPAC Name[3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine
SMILESNCC1CC(Oc2ncc(Cl)cc2Br)C1
InChIInChI=1S/C10H12BrClN2O/c11-9-3-7(12)5-14-10(9)15-8-1-6(2-8)4-13/h3,5-6,8H,1-2,4,13H2
InChIKeyHWYGGSFSCTZCRR-UHFFFAOYSA-N
XLogP2.61
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.58
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(azetidin-3-yloxy)-3-bromo-5-chloropyridine
CID 114838242
3-bromo-5-chloro-2-(cyclopropylmethoxy)pyridine
CID 114837615
3-bromo-5-chloro-2-(3-methoxycyclohexyl)oxypyridine
CID 114837770
3-bromo-5-chloro-2-(cyclopentylmethoxy)pyridine
CID 114837797
3-bromo-5-chloro-2-(oxan-4-ylmethoxy)pyridine
CID 114837736
5-bromo-6-(3,5-dimethylcyclohexyl)oxypyridin-3-amine
CID 79535668
[5-bromo-6-(oxetan-3-yloxy)-3-pyridinyl]methanamine
CID 130550933
3-bromo-5-chloro-N-(cyclopropylmethyl)pyridin-2-amine
CID 114835596
[3-[(3-bromo-5-chloro-2-pyridinyl)amino]cyclobutyl]methanol
CID 164654299
[2-[(3-bromo-5-chloro-2-pyridinyl)oxy]-4-chlorophenyl]methanamine
CID 114838134
5-bromo-6-(oxetan-3-yloxy)pyridin-3-amine
CID 102605464
3-bromo-5-chloro-2-(oxolan-2-ylmethoxy)pyridine
CID 114837569

Frequently Asked Questions

What is the IUPAC name of [3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine?
The IUPAC name of [3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine (CID 114838257) is [3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine.
What is the SMILES notation for [3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine?
The canonical SMILES for [3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine is NCC1CC(Oc2ncc(Cl)cc2Br)C1.
What is the InChIKey of [3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine?
The InChIKey is HWYGGSFSCTZCRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrClN2O/c11-9-3-7(12)5-14-10(9)15-8-1-6(2-8)4-13/h3,5-6,8H,1-2,4,13H2.
What are the key properties of [3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine?
[3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine has a molecular weight of 291.58 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(3-bromo-5-chloro-2-pyridinyl)oxy]cyclobutyl]methanamine is sourced from PubChem (CID 114838257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).