4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one

C15H18N2O2 — CID 60728850

IUPAC4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one
SMILESO=C1CN(C(=O)C2CCCc3ccccc32)CCN1
InChIInChI=1S/C15H18N2O2/c18-14-10-17(9-8-16-14)15(19)13-7-3-5-11-4-1-2-6-12(11)13/h1-2,4,6,13H,3,5,7-10H2,(H,16,18)
InChIKeyRENZLSYVILPCJM-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.06
Rot. Bonds1

About 4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one

4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one (PubChem CID 60728850) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one.

Molecular Properties

Compound Name4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one
PubChem CID60728850
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one
SMILESO=C1CN(C(=O)C2CCCc3ccccc32)CCN1
InChIInChI=1S/C15H18N2O2/c18-14-10-17(9-8-16-14)15(19)13-7-3-5-11-4-1-2-6-12(11)13/h1-2,4,6,13H,3,5,7-10H2,(H,16,18)
InChIKeyRENZLSYVILPCJM-UHFFFAOYSA-N
XLogP1.06
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dihydro-1H-isoquinolin-2-yl(1,2,3,4-tetrahydronaphthalen-1-yl)methanone
CID 134034276
(1-oxo-1,4-thiazinan-4-yl)-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]methanone
CID 95593666
(3-aminoazetidin-1-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone
CID 63755635
4-(2,3-dihydro-1-benzothiophene-3-carbonyl)piperazin-2-one
CID 78993619
(4-methylpiperidin-1-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone
CID 134062077
[4-(bromomethyl)piperidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone
CID 80678102
(4-hydroxy-4-methylpiperidin-1-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone
CID 80706477
1-(1,2,3,4-tetrahydroisoquinoline-4-carbonyl)-1,4-diazepan-5-one
CID 65262352
(4,4-difluoropiperidin-1-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone
CID 139029214
(4-pyrimidin-2-ylpiperazin-1-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone
CID 134034354
[(3S)-3-aminopyrrolidin-1-yl]-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone;hydrochloride
CID 119934524
1-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperidine-4-carbonitrile
CID 49062477

Frequently Asked Questions

What is the IUPAC name of 4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one?
The IUPAC name of 4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one (CID 60728850) is 4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one.
What is the SMILES notation for 4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one?
The canonical SMILES for 4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one is O=C1CN(C(=O)C2CCCc3ccccc32)CCN1.
What is the InChIKey of 4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one?
The InChIKey is RENZLSYVILPCJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c18-14-10-17(9-8-16-14)15(19)13-7-3-5-11-4-1-2-6-12(11)13/h1-2,4,6,13H,3,5,7-10H2,(H,16,18).
What are the key properties of 4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one?
4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one has a molecular weight of 258.32 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-2-one is sourced from PubChem (CID 60728850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).