2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine

C15H25N3 — CID 64947937

IUPAC2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine
SMILESCCCC1CN(Cc2cccc(C)n2)C(C)CN1
InChIInChI=1S/C15H25N3/c1-4-6-14-10-18(13(3)9-16-14)11-15-8-5-7-12(2)17-15/h5,7-8,13-14,16H,4,6,9-11H2,1-3H3
InChIKeyKEPDZDDVTCELHW-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.35
Rot. Bonds4

About 2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine

2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine (PubChem CID 64947937) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine.

Molecular Properties

Compound Name2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine
PubChem CID64947937
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine
SMILESCCCC1CN(Cc2cccc(C)n2)C(C)CN1
InChIInChI=1S/C15H25N3/c1-4-6-14-10-18(13(3)9-16-14)11-15-8-5-7-12(2)17-15/h5,7-8,13-14,16H,4,6,9-11H2,1-3H3
InChIKeyKEPDZDDVTCELHW-UHFFFAOYSA-N
XLogP2.35
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-tert-butyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine
CID 79263883
5-tert-butyl-1-[(6-methyl-2-pyridinyl)methyl]-2-propylpiperazine
CID 79263896
1-[(5-bromo-2-pyridinyl)methyl]-2-methyl-5-propylpiperazine
CID 104812364
5-ethyl-1-[(6-methoxy-2-pyridinyl)methyl]-2-methylpiperazine
CID 64841716
1-[(2-methoxyphenyl)methyl]-2-methyl-5-propylpiperazine
CID 64846377
4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine
CID 64945783
3-methyl-4-[(6-methyl-2-pyridinyl)methyl]-1,4-diazaspiro[5.5]undecane
CID 64947932
1-[(5-chlorothiophen-2-yl)methyl]-2-methyl-5-propylpiperazine
CID 64846938
1-[(2,5-dichlorophenyl)methyl]-2-methyl-5-propylpiperazine
CID 65317892
2-methyl-1-(3-phenoxypropyl)-5-propylpiperazine
CID 64846367
2,5,5-triethyl-1-[(6-methyl-2-pyridinyl)methyl]piperazine
CID 64947930
2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine
CID 82884970

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine?
The IUPAC name of 2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine (CID 64947937) is 2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine.
What is the SMILES notation for 2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine?
The canonical SMILES for 2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine is CCCC1CN(Cc2cccc(C)n2)C(C)CN1.
What is the InChIKey of 2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine?
The InChIKey is KEPDZDDVTCELHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-6-14-10-18(13(3)9-16-14)11-15-8-5-7-12(2)17-15/h5,7-8,13-14,16H,4,6,9-11H2,1-3H3.
What are the key properties of 2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine?
2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine has a molecular weight of 247.39 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[(6-methyl-2-pyridinyl)methyl]-5-propylpiperazine is sourced from PubChem (CID 64947937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).