2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine

C15H30N2 — CID 114102157

IUPAC2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine
SMILESCCC1CNC(C)(CC)CN1CC1(CC)CC1
InChIInChI=1S/C15H30N2/c1-5-13-10-16-14(4,6-2)11-17(13)12-15(7-3)8-9-15/h13,16H,5-12H2,1-4H3
InChIKeyPSGJWWNRHCZXJI-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.03
Rot. Bonds5

About 2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine

2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine (PubChem CID 114102157) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine.

Molecular Properties

Compound Name2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine
PubChem CID114102157
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine
SMILESCCC1CNC(C)(CC)CN1CC1(CC)CC1
InChIInChI=1S/C15H30N2/c1-5-13-10-16-14(4,6-2)11-17(13)12-15(7-3)8-9-15/h13,16H,5-12H2,1-4H3
InChIKeyPSGJWWNRHCZXJI-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-diethyl-5-methyl-1-[(2-methylthiolan-2-yl)methyl]piperazine
CID 80730833
1-butyl-2,5-diethyl-5-methylpiperazine
CID 64847702
2,5-diethyl-5-methyl-1-prop-2-ynylpiperazine
CID 64933219
2,5-diethyl-1-[(4-ethylcyclohexyl)methyl]-5-methylpiperazine
CID 64946947
3-(2,5-diethyl-5-methylpiperazin-1-yl)-N,N-dimethylpropan-1-amine
CID 64935969
1-[(5,5-dimethyloxolan-2-yl)methyl]-2,5-diethyl-5-methylpiperazine
CID 116524523
1-benzyl-2,5-diethyl-5-methylpiperazine
CID 64849828
2,5-diethyl-5-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperazine
CID 64948112
2,5-diethyl-1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-5-methylpiperazine
CID 104567913
2,5-diethyl-1-(2-ethylhexyl)-5-methylpiperazine
CID 64849443
1-[(3,5-difluorophenyl)methyl]-2,5-diethyl-5-methylpiperazine
CID 105410083
2,5-diethyl-1-[(5-fluoro-2-methylphenyl)methyl]-5-methylpiperazine
CID 105375725

Frequently Asked Questions

What is the IUPAC name of 2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine?
The IUPAC name of 2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine (CID 114102157) is 2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine.
What is the SMILES notation for 2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine?
The canonical SMILES for 2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine is CCC1CNC(C)(CC)CN1CC1(CC)CC1.
What is the InChIKey of 2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine?
The InChIKey is PSGJWWNRHCZXJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-5-13-10-16-14(4,6-2)11-17(13)12-15(7-3)8-9-15/h13,16H,5-12H2,1-4H3.
What are the key properties of 2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine?
2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine has a molecular weight of 238.42 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diethyl-1-[(1-ethylcyclopropyl)methyl]-5-methylpiperazine is sourced from PubChem (CID 114102157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).