1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine

C10H14BrN3 — CID 106879157

IUPAC1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine
SMILESCc1ccnc(N2CC(C)(N)C2)c1Br
InChIInChI=1S/C10H14BrN3/c1-7-3-4-13-9(8(7)11)14-5-10(2,12)6-14/h3-4H,5-6,12H2,1-2H3
InChIKeyBUSUSYCZMWPLLY-UHFFFAOYSA-N
MW256.15 g/mol
LogP1.69
Rot. Bonds1

About 1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine

1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine (PubChem CID 106879157) has the molecular formula C10H14BrN3 and a molecular weight of 256.15 g/mol. Its IUPAC name is 1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine.

Molecular Properties

Compound Name1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine
PubChem CID106879157
Molecular FormulaC10H14BrN3
Molecular Weight256.15 g/mol
Exact Mass255.04
IUPAC Name1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine
SMILESCc1ccnc(N2CC(C)(N)C2)c1Br
InChIInChI=1S/C10H14BrN3/c1-7-3-4-13-9(8(7)11)14-5-10(2,12)6-14/h3-4H,5-6,12H2,1-2H3
InChIKeyBUSUSYCZMWPLLY-UHFFFAOYSA-N
XLogP1.69
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.15
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-ol
CID 106876353
4-(3-bromo-4-methyl-2-pyridinyl)-2,2,6-trimethylmorpholine
CID 106876961
1-(3-bromo-4-methyl-2-pyridinyl)-N,N-dimethylpiperidin-4-amine
CID 106876604
3-bromo-2-(4-chloropiperidin-1-yl)-4-methylpyridine
CID 106878850
[1-(3-bromo-4-methyl-2-pyridinyl)pyrrolidin-3-yl]methanamine
CID 106876092
1-(3-bromo-4-methyl-2-pyridinyl)-4-propylpiperazine
CID 106876419
4-[4-(3-bromo-4-methyl-2-pyridinyl)piperazin-1-yl]butan-1-amine
CID 106875241
[1-(3-bromo-4-methyl-2-pyridinyl)piperidin-4-yl]methanol
CID 106876332
1-(3-bromo-4-methyl-2-pyridinyl)pyrrolidine-3-carboxamide
CID 107257846
7-(3-bromo-4-methyl-2-pyridinyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 106877064
1-(azetidin-3-yl)-4-(3-bromo-4-methyl-2-pyridinyl)piperazine
CID 106876171
3-[4-(3-bromo-4-methyl-2-pyridinyl)piperazin-1-yl]pentan-1-amine
CID 106875247

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine?
The IUPAC name of 1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine (CID 106879157) is 1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine.
What is the SMILES notation for 1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine?
The canonical SMILES for 1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine is Cc1ccnc(N2CC(C)(N)C2)c1Br.
What is the InChIKey of 1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine?
The InChIKey is BUSUSYCZMWPLLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrN3/c1-7-3-4-13-9(8(7)11)14-5-10(2,12)6-14/h3-4H,5-6,12H2,1-2H3.
What are the key properties of 1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine?
1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine has a molecular weight of 256.15 g/mol, XLogP of 1.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromo-4-methyl-2-pyridinyl)-3-methylazetidin-3-amine is sourced from PubChem (CID 106879157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).