5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine

C14H23N3 — CID 64940428

IUPAC5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine
SMILESCCC1CN(Cc2ncccc2C)C(C)CN1
InChIInChI=1S/C14H23N3/c1-4-13-9-17(12(3)8-16-13)10-14-11(2)6-5-7-15-14/h5-7,12-13,16H,4,8-10H2,1-3H3
InChIKeyBUPHLWYACFEERO-UHFFFAOYSA-N
MW233.36 g/mol
LogP1.96
Rot. Bonds3

About 5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine

5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine (PubChem CID 64940428) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine.

Molecular Properties

Compound Name5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine
PubChem CID64940428
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine
SMILESCCC1CN(Cc2ncccc2C)C(C)CN1
InChIInChI=1S/C14H23N3/c1-4-13-9-17(12(3)8-16-13)10-14-11(2)6-5-7-15-14/h5-7,12-13,16H,4,8-10H2,1-3H3
InChIKeyBUPHLWYACFEERO-UHFFFAOYSA-N
XLogP1.96
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethyl-1-[(3-ethyl-2-pyridinyl)methyl]-2-methylpiperazine
CID 82745598
2-tert-butyl-5-ethyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine
CID 115982506
3-ethyl-1-[(3-methyl-2-pyridinyl)methyl]-1,4-diazepane
CID 64950792
1-[(2-bromophenyl)methyl]-5-ethyl-2-methylpiperazine
CID 64840935
5-ethyl-1-[(2-methoxyphenyl)methyl]-2-methylpiperazine
CID 64840938
5-ethyl-1-[(6-methoxy-2-pyridinyl)methyl]-2-methylpiperazine
CID 64841716
5-ethyl-2-methyl-1-[(1-methyltriazol-4-yl)methyl]piperazine
CID 107055600
2-[(5-ethyl-2-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
CID 64841330
(3aR,6aS)-5-[(3-methyl-2-pyridinyl)methyl]-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;hydrochloride
CID 120660794
1-[(3-bromothiophen-2-yl)methyl]-5-ethyl-2-methylpiperazine
CID 64842685
1-[(2-chloro-3-pyridinyl)methyl]-2,5-diethylpiperazine
CID 64979145
3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine
CID 112650958

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine?
The IUPAC name of 5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine (CID 64940428) is 5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine.
What is the SMILES notation for 5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine?
The canonical SMILES for 5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine is CCC1CN(Cc2ncccc2C)C(C)CN1.
What is the InChIKey of 5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine?
The InChIKey is BUPHLWYACFEERO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-4-13-9-17(12(3)8-16-13)10-14-11(2)6-5-7-15-14/h5-7,12-13,16H,4,8-10H2,1-3H3.
What are the key properties of 5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine?
5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine has a molecular weight of 233.36 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperazine is sourced from PubChem (CID 64940428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).