2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone

C21H35N3O3 — CID 46023967

IUPAC2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone
SMILESO=C(C1CCCC1)N1CCN(C(C(=O)N2CCOCC2)C2CCCC2)CC1
InChIInChI=1S/C21H35N3O3/c25-20(18-7-3-4-8-18)23-11-9-22(10-12-23)19(17-5-1-2-6-17)21(26)24-13-15-27-16-14-24/h17-19H,1-16H2
InChIKeyIZVYDRPLBYHXTF-UHFFFAOYSA-N
MW377.53 g/mol
LogP1.74
Rot. Bonds4

About 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone

2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone (PubChem CID 46023967) has the molecular formula C21H35N3O3 and a molecular weight of 377.53 g/mol. Its IUPAC name is 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone
PubChem CID46023967
Molecular FormulaC21H35N3O3
Molecular Weight377.53 g/mol
Exact Mass377.27
IUPAC Name2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone
SMILESO=C(C1CCCC1)N1CCN(C(C(=O)N2CCOCC2)C2CCCC2)CC1
InChIInChI=1S/C21H35N3O3/c25-20(18-7-3-4-8-18)23-11-9-22(10-12-23)19(17-5-1-2-6-17)21(26)24-13-15-27-16-14-24/h17-19H,1-16H2
InChIKeyIZVYDRPLBYHXTF-UHFFFAOYSA-N
XLogP1.74
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.53
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone with MolForge

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Related Compounds

1-[4-(1-Cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylpropan-1-one
CID 24719804
1-[4-(1-Cyclopentyl-2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-methylbutan-1-one
CID 24719813
1-[4-[1-Cyclopentyl-2-(2-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]propan-1-one
CID 24719829
2-Cyclopentyl-2-[4-(2-methoxyacetyl)piperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone
CID 24719833
1-[4-[1-Cyclopentyl-2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-3-methylbutan-1-one
CID 24719854
Cyclohexyl[2-(2-morpholinoethyl)piperidino]methanone
CID 53193420
3-[4-(2-Cyclopentylacetyl)piperazino]-1-(2-methoxyethyl)-2-pyrrolidinone
CID 91925729
3-Cyclopentyl-1-[2-(morpholin-4-ylmethyl)azepan-1-yl]propan-1-one
CID 124042358
2-Cyclopentyl-1-[2-(morpholin-4-ylmethyl)azepan-1-yl]ethanone
CID 124042359
3-Methyl-1-[2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decan-8-YL]butan-1-one
CID 124045046
8-Cyclopentanecarbonyl-2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decane
CID 124045053
2-Cyclohexyl-1-[2-methyl-3-(morpholine-4-carbonyl)-2,8-diazaspiro[4.5]decan-8-YL]ethan-1-one
CID 124045054

Frequently Asked Questions

What is the IUPAC name of 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone?
The IUPAC name of 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone (CID 46023967) is 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone is O=C(C1CCCC1)N1CCN(C(C(=O)N2CCOCC2)C2CCCC2)CC1.
What is the InChIKey of 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone?
The InChIKey is IZVYDRPLBYHXTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H35N3O3/c25-20(18-7-3-4-8-18)23-11-9-22(10-12-23)19(17-5-1-2-6-17)21(26)24-13-15-27-16-14-24/h17-19H,1-16H2.
What are the key properties of 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone?
2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone has a molecular weight of 377.53 g/mol, XLogP of 1.74, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclopentanecarbonyl)piperazin-1-yl]-2-cyclopentyl-1-morpholin-4-ylethanone is sourced from PubChem (CID 46023967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).