ethane;1-ethyl-4-methyl-2-methylidenepiperazine

C12H28N2 — CID 91069058

IUPACethane;1-ethyl-4-methyl-2-methylidenepiperazine
SMILESC=C1CN(C)CCN1CC.CC.CC
InChIInChI=1S/C8H16N2.2C2H6/c1-4-10-6-5-9(3)7-8(10)2;2*1-2/h2,4-7H2,1,3H3;2*1-2H3
InChIKeyVFENLXCCEAYPOT-UHFFFAOYSA-N
MW200.37 g/mol
LogP2.82
Rot. Bonds1

About ethane;1-ethyl-4-methyl-2-methylidenepiperazine

ethane;1-ethyl-4-methyl-2-methylidenepiperazine (PubChem CID 91069058) has the molecular formula C12H28N2 and a molecular weight of 200.37 g/mol. Its IUPAC name is ethane;1-ethyl-4-methyl-2-methylidenepiperazine.

Molecular Properties

Compound Nameethane;1-ethyl-4-methyl-2-methylidenepiperazine
PubChem CID91069058
Molecular FormulaC12H28N2
Molecular Weight200.37 g/mol
Exact Mass200.23
IUPAC Nameethane;1-ethyl-4-methyl-2-methylidenepiperazine
SMILESC=C1CN(C)CCN1CC.CC.CC
InChIInChI=1S/C8H16N2.2C2H6/c1-4-10-6-5-9(3)7-8(10)2;2*1-2/h2,4-7H2,1,3H3;2*1-2H3
InChIKeyVFENLXCCEAYPOT-UHFFFAOYSA-N
XLogP2.82
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.37
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-Fluorobuta-1,3-dien-2-yl)-4-methylpiperazine
CID 123346502
4-Fluoro-1-methyl-2-methylidenepiperazine
CID 156747861
1-[(2E,4E)-5-fluorohexa-2,4-dien-3-yl]-4-methylpiperazine
CID 174194314
1,4-Dimethyl-2,3-dimethylidenepiperazine
CID 12840741
1-Ethyl-4-prop-1-en-2-ylpiperazine
CID 20829762
1-Methyl-4-prop-1-en-2-ylpiperazine
CID 21366497
1-N-[2-(diethylamino)ethyl]-1-N,2-N,2-N-triethylprop-2-ene-1,2-diamine
CID 23542188
N,N,N'-triethyl-N'-[2-[ethyl(prop-1-en-2-yl)amino]ethyl]ethane-1,2-diamine
CID 23542189
2-Methylidene-1-propylpiperazine
CID 53630616
1,4-Dimethyl-2-methylidenepiperazine
CID 54488727
3-Methylidene-1-propan-2-ylpiperazine
CID 57531005
1-Methyl-4-(3-methylbut-1-en-2-yl)piperazine
CID 57797750

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethyl-4-methyl-2-methylidenepiperazine?
The IUPAC name of ethane;1-ethyl-4-methyl-2-methylidenepiperazine (CID 91069058) is ethane;1-ethyl-4-methyl-2-methylidenepiperazine.
What is the SMILES notation for ethane;1-ethyl-4-methyl-2-methylidenepiperazine?
The canonical SMILES for ethane;1-ethyl-4-methyl-2-methylidenepiperazine is C=C1CN(C)CCN1CC.CC.CC.
What is the InChIKey of ethane;1-ethyl-4-methyl-2-methylidenepiperazine?
The InChIKey is VFENLXCCEAYPOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2.2C2H6/c1-4-10-6-5-9(3)7-8(10)2;2*1-2/h2,4-7H2,1,3H3;2*1-2H3.
What are the key properties of ethane;1-ethyl-4-methyl-2-methylidenepiperazine?
ethane;1-ethyl-4-methyl-2-methylidenepiperazine has a molecular weight of 200.37 g/mol, XLogP of 2.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethyl-4-methyl-2-methylidenepiperazine is sourced from PubChem (CID 91069058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).