2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone

C16H30N2O — CID 64978349

IUPAC2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone
SMILESCCC1CN(C(=O)CC2CCCCC2)C(CC)CN1
InChIInChI=1S/C16H30N2O/c1-3-14-12-18(15(4-2)11-17-14)16(19)10-13-8-6-5-7-9-13/h13-15,17H,3-12H2,1-2H3
InChIKeyWCGVDECPBBCHJM-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.95
Rot. Bonds4

About 2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone

2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone (PubChem CID 64978349) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone.

Molecular Properties

Compound Name2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone
PubChem CID64978349
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone
SMILESCCC1CN(C(=O)CC2CCCCC2)C(CC)CN1
InChIInChI=1S/C16H30N2O/c1-3-14-12-18(15(4-2)11-17-14)16(19)10-13-8-6-5-7-9-13/h13-15,17H,3-12H2,1-2H3
InChIKeyWCGVDECPBBCHJM-UHFFFAOYSA-N
XLogP2.95
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,5-diethylpiperazin-1-yl)-2-(3-ethoxycyclobutyl)ethanone
CID 103164983
1-(2,5-diethylpiperazin-1-yl)butan-1-one
CID 64977925
cyclobutyl-(2,5-diethylpiperazin-1-yl)methanone
CID 64978279
azepan-1-yl-(2,5-diethylpiperazin-1-yl)methanone
CID 79152036
1-(2,5-diethylpiperazin-1-yl)octan-1-one
CID 64978357
1-(cyclopentylmethyl)-2,5-diethylpiperazine
CID 64843856
cyclopent-3-en-1-yl-(2,5-diethylpiperazin-1-yl)methanone
CID 64978451
2-(4-bromophenyl)-1-(2,5-diethylpiperazin-1-yl)ethanone
CID 64977891
1-(2-ethylazepan-1-yl)-2-piperidin-4-ylethanone
CID 112701871
1-(2,5-diethylpiperazin-1-yl)-2-(3,5-dimethylpyrazol-1-yl)ethanone
CID 64978366
4-(2-cyclohexylacetyl)-3-ethylpiperazin-2-one
CID 63600501
4-(2,5-diethylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 83192198

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone?
The IUPAC name of 2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone (CID 64978349) is 2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone.
What is the SMILES notation for 2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone?
The canonical SMILES for 2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone is CCC1CN(C(=O)CC2CCCCC2)C(CC)CN1.
What is the InChIKey of 2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone?
The InChIKey is WCGVDECPBBCHJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-3-14-12-18(15(4-2)11-17-14)16(19)10-13-8-6-5-7-9-13/h13-15,17H,3-12H2,1-2H3.
What are the key properties of 2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone?
2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone has a molecular weight of 266.43 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-(2,5-diethylpiperazin-1-yl)ethanone is sourced from PubChem (CID 64978349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).