[4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone

C15H28N2O2 — CID 163257255

IUPAC[4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone
SMILESCOCCN1CCN(C(=O)C2CCC(C)CC2)CC1
InChIInChI=1S/C15H28N2O2/c1-13-3-5-14(6-4-13)15(18)17-9-7-16(8-10-17)11-12-19-2/h13-14H,3-12H2,1-2H3
InChIKeyMHAXJOZXVWVPTN-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.60
Rot. Bonds4

About [4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone

[4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone (PubChem CID 163257255) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is [4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone.

Molecular Properties

Compound Name[4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone
PubChem CID163257255
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name[4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone
SMILESCOCCN1CCN(C(=O)C2CCC(C)CC2)CC1
InChIInChI=1S/C15H28N2O2/c1-13-3-5-14(6-4-13)15(18)17-9-7-16(8-10-17)11-12-19-2/h13-14H,3-12H2,1-2H3
InChIKeyMHAXJOZXVWVPTN-UHFFFAOYSA-N
XLogP1.60
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(3-methoxypropyl)piperazin-1-yl]-(oxan-4-yl)methanone
CID 113073396
(4R)-4-[4-(2-methoxyethyl)piperazine-1-carbonyl]-1-methylpyrrolidin-2-one
CID 94092850
1-[4-(2-methoxyethyl)piperazin-1-yl]propan-1-one
CID 59468982
ethane;1-(2-methoxyethyl)-4-methylpiperazine;methylcyclopropane
CID 144800701
3-azabicyclo[3.3.1]nonan-3-yl-[1-(2-methoxyethyl)piperidin-4-yl]methanone
CID 171153397
(4-aminocyclohexyl)-(4-propylpiperazin-1-yl)methanone
CID 60847754
[4-(4-methylpiperazine-1-carbonyl)cyclohexyl]-(4-methylpiperidin-1-yl)methanone
CID 109146216
(3-aminopyrrolidin-1-yl)-[1-(2-methoxyethyl)piperidin-4-yl]methanone;dihydrochloride
CID 154907860
[4-(2-methoxyethyl)piperazin-1-yl]-[(2R)-piperidin-2-yl]methanone
CID 119838507
[4-(2-methoxyethyl)piperazin-1-yl]-pyrrolidin-2-ylmethanone;dihydrochloride
CID 119838561
1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-2-methoxyethanone
CID 60637500
cyclobutyl-(4-pentylpiperazin-1-yl)methanone
CID 113075121

Frequently Asked Questions

What is the IUPAC name of [4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone?
The IUPAC name of [4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone (CID 163257255) is [4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone.
What is the SMILES notation for [4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone?
The canonical SMILES for [4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone is COCCN1CCN(C(=O)C2CCC(C)CC2)CC1.
What is the InChIKey of [4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone?
The InChIKey is MHAXJOZXVWVPTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-13-3-5-14(6-4-13)15(18)17-9-7-16(8-10-17)11-12-19-2/h13-14H,3-12H2,1-2H3.
What are the key properties of [4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone?
[4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone has a molecular weight of 268.40 g/mol, XLogP of 1.60, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-methoxyethyl)piperazin-1-yl]-(4-methylcyclohexyl)methanone is sourced from PubChem (CID 163257255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).