1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine

C14H22N4O — CID 106660885

IUPAC1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine
SMILESCOc1cnc(C)cc1N1CCN(C2CNC2)CC1
InChIInChI=1S/C14H22N4O/c1-11-7-13(14(19-2)10-16-11)18-5-3-17(4-6-18)12-8-15-9-12/h7,10,12,15H,3-6,8-9H2,1-2H3
InChIKeyCHYWIQWRYRTTRE-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.49
Rot. Bonds3

About 1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine

1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine (PubChem CID 106660885) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine.

Molecular Properties

Compound Name1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine
PubChem CID106660885
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine
SMILESCOc1cnc(C)cc1N1CCN(C2CNC2)CC1
InChIInChI=1S/C14H22N4O/c1-11-7-13(14(19-2)10-16-11)18-5-3-17(4-6-18)12-8-15-9-12/h7,10,12,15H,3-6,8-9H2,1-2H3
InChIKeyCHYWIQWRYRTTRE-UHFFFAOYSA-N
XLogP0.49
TPSA40.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[4-(azetidin-3-yl)piperazin-1-yl]-6-methylpyrimidine
CID 66201241
5-methoxy-2-methyl-4-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine
CID 106660829
1-(5-methoxy-2-methyl-4-pyridinyl)piperidin-3-amine
CID 106660795
1-(5-methoxy-2-methyl-4-pyridinyl)-3-methylpiperidin-4-amine
CID 106660907
3-[4-(azetidin-3-yl)piperazin-1-yl]-5-methylpyridazine
CID 106550211
1-(azetidin-3-yl)-4-(5-bromo-3-methyl-2-pyridinyl)piperazine
CID 79718223
N-[[4-(4-cyclopropylpiperazin-1-yl)-6-methyl-3-pyridinyl]methyl]ethanamine
CID 81248099
1-[1-(azetidin-3-yl)piperidin-4-yl]-4-[1-(5-methoxy-2-methyl-4-nitrophenyl)piperidin-4-yl]piperazine
CID 164853481
5-(chloromethyl)-4-(4-methoxypiperidin-1-yl)-2-methylpyridine
CID 81234681
N-(azetidin-3-yl)-N-ethyl-5-methoxy-2-methylpyridin-4-amine
CID 106660883
2-N-[4-[4-(azetidin-3-yl)piperazin-1-yl]-2-methoxy-5-methylphenyl]-5-bromo-4-N-(5-dimethylphosphanylquinoxalin-6-yl)pyrimidine-2,4-diamine
CID 175428464
1-(azetidin-3-yl)-4-(3-bromo-4-methyl-2-pyridinyl)piperazine
CID 106876171

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine?
The IUPAC name of 1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine (CID 106660885) is 1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine.
What is the SMILES notation for 1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine?
The canonical SMILES for 1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine is COc1cnc(C)cc1N1CCN(C2CNC2)CC1.
What is the InChIKey of 1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine?
The InChIKey is CHYWIQWRYRTTRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-11-7-13(14(19-2)10-16-11)18-5-3-17(4-6-18)12-8-15-9-12/h7,10,12,15H,3-6,8-9H2,1-2H3.
What are the key properties of 1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine?
1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine has a molecular weight of 262.36 g/mol, XLogP of 0.49, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)-4-(5-methoxy-2-methyl-4-pyridinyl)piperazine is sourced from PubChem (CID 106660885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).