1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine

C9H21N3O — CID 79659006

IUPAC1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine
SMILESCOCC(N)C1CN(C)CCN1C
InChIInChI=1S/C9H21N3O/c1-11-4-5-12(2)9(6-11)8(10)7-13-3/h8-9H,4-7,10H2,1-3H3
InChIKeyIACIYOUAIKZJSG-UHFFFAOYSA-N
MW187.29 g/mol
LogP-0.79
Rot. Bonds3

About 1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine

1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine (PubChem CID 79659006) has the molecular formula C9H21N3O and a molecular weight of 187.29 g/mol. Its IUPAC name is 1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine.

Molecular Properties

Compound Name1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine
PubChem CID79659006
Molecular FormulaC9H21N3O
Molecular Weight187.29 g/mol
Exact Mass187.17
IUPAC Name1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine
SMILESCOCC(N)C1CN(C)CCN1C
InChIInChI=1S/C9H21N3O/c1-11-4-5-12(2)9(6-11)8(10)7-13-3/h8-9H,4-7,10H2,1-3H3
InChIKeyIACIYOUAIKZJSG-UHFFFAOYSA-N
XLogP-0.79
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.29
LogP ≤ 5-0.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1,4-dimethyl-1,4-diazepan-2-yl)-4-methoxybutan-1-amine
CID 114856805
1-(1,4-dimethylpiperazin-2-yl)-4-methylpentan-1-amine
CID 79658576
1-(1,4-dimethylpiperazin-2-yl)-2-methylbutan-1-amine
CID 79659340
1-(1,4-dimethylpiperazin-2-yl)-2-methylpropan-1-amine
CID 79659665
1-(1,4-dimethylpiperazin-2-yl)-2-phenylethanamine
CID 79658342
1-(1,4-dimethylpiperazin-2-yl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanamine
CID 79663946
3-cyclopentyl-1-(1,4-dimethyl-1,4-diazepan-2-yl)propan-1-amine
CID 114192224
1-[(1,4-dimethylpiperazin-2-yl)methylamino]-3-methoxypropan-2-ol
CID 63930922
3-[2-amino-2-(1,4-dimethylpiperazin-2-yl)ethyl]pyridin-2-amine
CID 79659414
1-(1,4-dimethylpiperazin-2-yl)-2-ethoxy-N-ethylethanamine
CID 79659517
2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(1,4-dimethylpiperazin-2-yl)ethanamine
CID 79659585
(1,4-dimethylpiperazin-2-yl)-(3-ethylcyclohexyl)methanamine
CID 79658674

Frequently Asked Questions

What is the IUPAC name of 1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine?
The IUPAC name of 1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine (CID 79659006) is 1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine.
What is the SMILES notation for 1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine?
The canonical SMILES for 1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine is COCC(N)C1CN(C)CCN1C.
What is the InChIKey of 1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine?
The InChIKey is IACIYOUAIKZJSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O/c1-11-4-5-12(2)9(6-11)8(10)7-13-3/h8-9H,4-7,10H2,1-3H3.
What are the key properties of 1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine?
1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine has a molecular weight of 187.29 g/mol, XLogP of -0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,4-dimethylpiperazin-2-yl)-2-methoxyethanamine is sourced from PubChem (CID 79659006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).