1-(2-phenylmethoxyphenyl)sulfonylpiperazine

C17H20N2O3S — CID 70053315

IUPAC1-(2-phenylmethoxyphenyl)sulfonylpiperazine
SMILESO=S(=O)(c1ccccc1OCc1ccccc1)N1CCNCC1
InChIInChI=1S/C17H20N2O3S/c20-23(21,19-12-10-18-11-13-19)17-9-5-4-8-16(17)22-14-15-6-2-1-3-7-15/h1-9,18H,10-14H2
InChIKeyFCUJDCYVKOXHEB-UHFFFAOYSA-N
MW332.43 g/mol
LogP1.86
Rot. Bonds5

About 1-(2-phenylmethoxyphenyl)sulfonylpiperazine

1-(2-phenylmethoxyphenyl)sulfonylpiperazine (PubChem CID 70053315) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is 1-(2-phenylmethoxyphenyl)sulfonylpiperazine.

Molecular Properties

Compound Name1-(2-phenylmethoxyphenyl)sulfonylpiperazine
PubChem CID70053315
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC Name1-(2-phenylmethoxyphenyl)sulfonylpiperazine
SMILESO=S(=O)(c1ccccc1OCc1ccccc1)N1CCNCC1
InChIInChI=1S/C17H20N2O3S/c20-23(21,19-12-10-18-11-13-19)17-9-5-4-8-16(17)22-14-15-6-2-1-3-7-15/h1-9,18H,10-14H2
InChIKeyFCUJDCYVKOXHEB-UHFFFAOYSA-N
XLogP1.86
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(4-phenylmethoxy-3-pyridinyl)sulfonyl]piperazine
CID 102538666
hydron;1-(2-methoxyphenyl)sulfonylpiperazine;chloride
CID 51066589
1-(2-propan-2-yloxyphenyl)sulfonylpiperazine
CID 141221237
1-naphthalen-1-ylsulfonylpiperazine
CID 42626101
1-[4-(2-methoxyphenyl)sulfonylpiperazin-1-yl]-2-phenylethanone
CID 110818318
1-[(1R)-3,3,3-trifluoro-1-(2-phenylmethoxyphenyl)propyl]piperazine
CID 171172743
1-[(1R)-1-(2-phenylmethoxyphenyl)butyl]piperazine;dihydrochloride
CID 171295565
1-(2-bromophenyl)sulfonyl-1,4-diazepane
CID 28973443
1-[5-(difluoromethoxy)naphthalen-1-yl]sulfonylpiperazine
CID 176668113
[4-[(2-bromophenoxy)methyl]phenyl]-piperazin-1-ylmethanone
CID 119402210
1-[(R)-cyclopropyl-(2-phenylmethoxyphenyl)methyl]piperazine
CID 171295550
1-phenylmethoxy-2-[4-[[4-[[4-(2-phenylmethoxyphenyl)sulfonylphenoxy]methyl]phenyl]methoxy]phenyl]sulfonylbenzene
CID 139826912

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenylmethoxyphenyl)sulfonylpiperazine?
The IUPAC name of 1-(2-phenylmethoxyphenyl)sulfonylpiperazine (CID 70053315) is 1-(2-phenylmethoxyphenyl)sulfonylpiperazine.
What is the SMILES notation for 1-(2-phenylmethoxyphenyl)sulfonylpiperazine?
The canonical SMILES for 1-(2-phenylmethoxyphenyl)sulfonylpiperazine is O=S(=O)(c1ccccc1OCc1ccccc1)N1CCNCC1.
What is the InChIKey of 1-(2-phenylmethoxyphenyl)sulfonylpiperazine?
The InChIKey is FCUJDCYVKOXHEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c20-23(21,19-12-10-18-11-13-19)17-9-5-4-8-16(17)22-14-15-6-2-1-3-7-15/h1-9,18H,10-14H2.
What are the key properties of 1-(2-phenylmethoxyphenyl)sulfonylpiperazine?
1-(2-phenylmethoxyphenyl)sulfonylpiperazine has a molecular weight of 332.43 g/mol, XLogP of 1.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenylmethoxyphenyl)sulfonylpiperazine is sourced from PubChem (CID 70053315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).