1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one

C10H20N2O2 — CID 59468982

IUPAC1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one
SMILESCCC(=O)N1CCN(CCOC)CC1
InChIInChI=1S/C10H20N2O2/c1-3-10(13)12-6-4-11(5-7-12)8-9-14-2/h3-9H2,1-2H3
InChIKeyPNRMZTGBIGQGMI-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.19
Rot. Bonds4

About 1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one

1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one (PubChem CID 59468982) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one.

Molecular Properties

Compound Name1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one
PubChem CID59468982
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one
SMILESCCC(=O)N1CCN(CCOC)CC1
InChIInChI=1S/C10H20N2O2/c1-3-10(13)12-6-4-11(5-7-12)8-9-14-2/h3-9H2,1-2H3
InChIKeyPNRMZTGBIGQGMI-UHFFFAOYSA-N
XLogP0.19
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-iodo-1-[4-(2-methoxyethyl)piperazin-1-yl]ethanone
CID 155022940
ethane;1-(4-propylpiperazin-1-yl)propan-1-one
CID 171788369
3-[4-(2-methoxyethyl)piperazin-1-yl]-1-piperidin-1-ylpropan-1-one
CID 86931018
3-[4-(2-methoxyethyl)-1,4-diazepan-1-yl]-3-oxopropanoic acid
CID 62229918
1-[4-(2-piperazin-1-ylethyl)piperazin-1-yl]propan-1-one
CID 178104609
1-[4-[(4-propylpiperazin-1-yl)methyl]piperazin-1-yl]propan-1-one
CID 178000242
2-[2-[4-(2-methoxyethyl)-1,4-diazepan-1-yl]-2-oxoethoxy]acetic acid
CID 61327126
2-(cyclopropylmethylamino)-1-[4-(2-methoxyethyl)piperazin-1-yl]ethanone;dihydrochloride
CID 119838548
ethane;1-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]propan-1-one
CID 145317159
[4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone
CID 163257255
4-[4-(2-methoxyethyl)-1,4-diazepan-1-yl]-2,2-dimethyl-4-oxobutanoic acid
CID 65302083
N-tert-butyl-4-(2-methoxyethyl)piperazine-1-carboxamide
CID 113104934

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one?
The IUPAC name of 1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one (CID 59468982) is 1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one.
What is the SMILES notation for 1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one?
The canonical SMILES for 1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one is CCC(=O)N1CCN(CCOC)CC1.
What is the InChIKey of 1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one?
The InChIKey is PNRMZTGBIGQGMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-3-10(13)12-6-4-11(5-7-12)8-9-14-2/h3-9H2,1-2H3.
What are the key properties of 1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one?
1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one has a molecular weight of 200.28 g/mol, XLogP of 0.19, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one is sourced from PubChem (CID 59468982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).