(2S,6R)-4-ethyl-1,2,6-trimethylpiperazine

C9H20N2 — CID 138484607

IUPAC(2S,6R)-4-ethyl-1,2,6-trimethylpiperazine
SMILESCCN1C[C@@H](C)N(C)[C@@H](C)C1
InChIInChI=1S/C9H20N2/c1-5-11-6-8(2)10(4)9(3)7-11/h8-9H,5-7H2,1-4H3/t8-,9+
InChIKeyOBFNHHAPTCCVJR-DTORHVGOSA-N
MW156.27 g/mol
LogP1.03
Rot. Bonds1

About (2S,6R)-4-ethyl-1,2,6-trimethylpiperazine

(2S,6R)-4-ethyl-1,2,6-trimethylpiperazine (PubChem CID 138484607) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is (2S,6R)-4-ethyl-1,2,6-trimethylpiperazine.

Molecular Properties

Compound Name(2S,6R)-4-ethyl-1,2,6-trimethylpiperazine
PubChem CID138484607
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name(2S,6R)-4-ethyl-1,2,6-trimethylpiperazine
SMILESCCN1C[C@@H](C)N(C)[C@@H](C)C1
InChIInChI=1S/C9H20N2/c1-5-11-6-8(2)10(4)9(3)7-11/h8-9H,5-7H2,1-4H3/t8-,9+
InChIKeyOBFNHHAPTCCVJR-DTORHVGOSA-N
XLogP1.03
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-butyl-1,2,6-trimethylpiperazine
CID 126991132
(2S,6R)-4-ethyl-2,6-dimethyl-1-propan-2-ylpiperazine
CID 135218538
propane;(2R)-1,2,4,6-tetramethylpiperazine
CID 143144472
(2S,6S)-1,2,6-trimethyl-4-(2-methylpropyl)piperazine
CID 171515774
(3R)-1-ethyl-3,4-dimethylpyrrolidine
CID 144761230
(2S,6S)-4-(cyclopropylmethyl)-1,2,6-trimethylpiperazine
CID 174261411
1,3-diethylazetidine;1,2-dimethylaziridine
CID 161379483
ethane;4-ethyl-1,2-dimethylpiperazine
CID 142283351
N-ethyl-1-(3,4,5-trimethylpiperazin-1-yl)propan-2-amine
CID 114537771
2-[(3,4,5-trimethylpiperazin-1-yl)methyl]butane-1-thiol
CID 114541064
1,2,4,6-tetramethylpiperazine
CID 22088083
1-(4-ethyl-2,6-dimethylpiperazin-1-yl)ethanone
CID 131132044

Frequently Asked Questions

What is the IUPAC name of (2S,6R)-4-ethyl-1,2,6-trimethylpiperazine?
The IUPAC name of (2S,6R)-4-ethyl-1,2,6-trimethylpiperazine (CID 138484607) is (2S,6R)-4-ethyl-1,2,6-trimethylpiperazine.
What is the SMILES notation for (2S,6R)-4-ethyl-1,2,6-trimethylpiperazine?
The canonical SMILES for (2S,6R)-4-ethyl-1,2,6-trimethylpiperazine is CCN1C[C@@H](C)N(C)[C@@H](C)C1.
What is the InChIKey of (2S,6R)-4-ethyl-1,2,6-trimethylpiperazine?
The InChIKey is OBFNHHAPTCCVJR-DTORHVGOSA-N. The full InChI is InChI=1S/C9H20N2/c1-5-11-6-8(2)10(4)9(3)7-11/h8-9H,5-7H2,1-4H3/t8-,9+.
What are the key properties of (2S,6R)-4-ethyl-1,2,6-trimethylpiperazine?
(2S,6R)-4-ethyl-1,2,6-trimethylpiperazine has a molecular weight of 156.27 g/mol, XLogP of 1.03, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,6R)-4-ethyl-1,2,6-trimethylpiperazine is sourced from PubChem (CID 138484607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).