[1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine

C10H14BrN3 — CID 79717951

IUPAC[1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine
SMILESCc1cc(Br)cnc1N1CC(CN)C1
InChIInChI=1S/C10H14BrN3/c1-7-2-9(11)4-13-10(7)14-5-8(3-12)6-14/h2,4,8H,3,5-6,12H2,1H3
InChIKeyYLWIKQJWOSDHNX-UHFFFAOYSA-N
MW256.15 g/mol
LogP1.55
Rot. Bonds2

About [1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine

[1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine (PubChem CID 79717951) has the molecular formula C10H14BrN3 and a molecular weight of 256.15 g/mol. Its IUPAC name is [1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine
PubChem CID79717951
Molecular FormulaC10H14BrN3
Molecular Weight256.15 g/mol
Exact Mass255.04
IUPAC Name[1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine
SMILESCc1cc(Br)cnc1N1CC(CN)C1
InChIInChI=1S/C10H14BrN3/c1-7-2-9(11)4-13-10(7)14-5-8(3-12)6-14/h2,4,8H,3,5-6,12H2,1H3
InChIKeyYLWIKQJWOSDHNX-UHFFFAOYSA-N
XLogP1.55
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.15
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanol
CID 79718833
[1-(5-bromo-3-chloro-2-pyridinyl)azetidin-3-yl]methanamine
CID 103584239
[1-(5-bromo-3-methyl-2-pyridinyl)piperidin-3-yl]methanol
CID 79719028
1-(5-bromo-3-methyl-2-pyridinyl)pyrrolidin-3-amine
CID 79718817
5-bromo-2-[4-(chloromethyl)piperidin-1-yl]-3-methylpyridine
CID 79718248
(3S)-1-(5-bromo-3-methyl-2-pyridinyl)-3-methylpiperazine
CID 96944496
4-(5-bromo-3-methyl-2-pyridinyl)-2-(chloromethyl)morpholine
CID 81210904
[1-(5-bromo-3-methyl-2-pyridinyl)-4-methylsulfanylpiperidin-4-yl]methanamine
CID 79712747
2-[4-(5-bromo-3-methyl-2-pyridinyl)piperazin-1-yl]butan-1-amine
CID 79713125
1-(5-bromo-3-methyl-2-pyridinyl)pyrrolidine-3-carboxamide
CID 103738540
1-(5-bromo-3-methyl-2-pyridinyl)-4-methylpiperidin-3-ol
CID 103896085
N-[[1-(5-bromo-3-methyl-2-pyridinyl)piperidin-3-yl]methyl]acetamide
CID 133360369

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine?
The IUPAC name of [1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine (CID 79717951) is [1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine.
What is the SMILES notation for [1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine?
The canonical SMILES for [1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine is Cc1cc(Br)cnc1N1CC(CN)C1.
What is the InChIKey of [1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine?
The InChIKey is YLWIKQJWOSDHNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrN3/c1-7-2-9(11)4-13-10(7)14-5-8(3-12)6-14/h2,4,8H,3,5-6,12H2,1H3.
What are the key properties of [1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine?
[1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine has a molecular weight of 256.15 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromo-3-methyl-2-pyridinyl)azetidin-3-yl]methanamine is sourced from PubChem (CID 79717951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).