2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone

C15H22N2O2 — CID 82263317

IUPAC2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone
SMILESCC(C)Oc1ccc(C(=O)CN2CCNCC2)cc1
InChIInChI=1S/C15H22N2O2/c1-12(2)19-14-5-3-13(4-6-14)15(18)11-17-9-7-16-8-10-17/h3-6,12,16H,7-11H2,1-2H3
InChIKeyRVYWMHIRLPOTSA-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.56
Rot. Bonds5

About 2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone

2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone (PubChem CID 82263317) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone.

Molecular Properties

Compound Name2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone
PubChem CID82263317
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone
SMILESCC(C)Oc1ccc(C(=O)CN2CCNCC2)cc1
InChIInChI=1S/C15H22N2O2/c1-12(2)19-14-5-3-13(4-6-14)15(18)11-17-9-7-16-8-10-17/h3-6,12,16H,7-11H2,1-2H3
InChIKeyRVYWMHIRLPOTSA-UHFFFAOYSA-N
XLogP1.56
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1,4-diazepan-1-yl)-1-(3-propan-2-yloxyphenyl)ethanone
CID 116565581
1-(4-propan-2-yloxyphenyl)-2-(4-prop-2-enylpiperazin-1-yl)ethanone
CID 118238777
1-(4-fluorophenyl)-2-piperazin-1-ylethanone
CID 16769083
1-(4-hydroxy-3-propan-2-ylphenyl)-2-piperazin-1-ylethanone
CID 82265834
1-[2-(4-propan-2-yloxyphenyl)ethyl]piperazine
CID 82255560
1-(4-methoxyphenyl)-2-[4-(2-methylpropyl)piperazin-1-yl]ethanone
CID 62777262
2-piperazin-1-yl-1-(3-propan-2-yl-4-propoxyphenyl)ethanone
CID 82264037
3-morpholin-4-yl-1-(4-propan-2-yloxyphenyl)propan-1-one;hydrochloride
CID 52997518
1-(3-ethyl-4-methoxyphenyl)-2-piperazin-1-ylethanone
CID 95468407
2-piperazin-1-yl-1-(1-propan-2-yl-3,4-dihydro-2H-quinolin-7-yl)ethanone
CID 82263629
1-[4-(2-methyl-4-piperazin-1-ylbutan-2-yl)oxyphenyl]propan-1-one
CID 139638679
1-piperazin-1-yl-3-(4-propan-2-yloxyphenyl)prop-2-en-1-one
CID 54096458

Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone?
The IUPAC name of 2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone (CID 82263317) is 2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone.
What is the SMILES notation for 2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone?
The canonical SMILES for 2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone is CC(C)Oc1ccc(C(=O)CN2CCNCC2)cc1.
What is the InChIKey of 2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone?
The InChIKey is RVYWMHIRLPOTSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-12(2)19-14-5-3-13(4-6-14)15(18)11-17-9-7-16-8-10-17/h3-6,12,16H,7-11H2,1-2H3.
What are the key properties of 2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone?
2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone has a molecular weight of 262.35 g/mol, XLogP of 1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone is sourced from PubChem (CID 82263317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).