1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine

C16H26N2O — CID 82303005

IUPAC1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine
SMILESCC(C)Oc1ccc(C(C)(C)N2CCNCC2)cc1
InChIInChI=1S/C16H26N2O/c1-13(2)19-15-7-5-14(6-8-15)16(3,4)18-11-9-17-10-12-18/h5-8,13,17H,9-12H2,1-4H3
InChIKeyDPFWONROXROFBT-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.61
Rot. Bonds4

About 1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine

1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine (PubChem CID 82303005) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine.

Molecular Properties

Compound Name1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine
PubChem CID82303005
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine
SMILESCC(C)Oc1ccc(C(C)(C)N2CCNCC2)cc1
InChIInChI=1S/C16H26N2O/c1-13(2)19-15-7-5-14(6-8-15)16(3,4)18-11-9-17-10-12-18/h5-8,13,17H,9-12H2,1-4H3
InChIKeyDPFWONROXROFBT-UHFFFAOYSA-N
XLogP2.61
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-[4-[(2-methylpropan-2-yl)oxy]phenyl]propan-2-yl]piperazine
CID 95480576
(3S)-2,2-dimethyl-3-piperazin-1-yl-3-(4-propan-2-yloxyphenyl)propan-1-ol;hydrochloride
CID 171190160
1-[2-(4-ethylsulfanylphenyl)propan-2-yl]piperazine
CID 82501523
1-[2-(4-propan-2-yloxyphenyl)ethyl]piperazine
CID 82255560
1-[(1R)-2-fluoro-1-(4-propan-2-yloxyphenyl)ethyl]piperazine
CID 171182676
1-[(S)-cyclopropyl-(4-propan-2-yloxyphenyl)methyl]piperazine
CID 95477475
1-[2-(3-fluoro-4-methoxyphenyl)propan-2-yl]piperazine
CID 82298206
1-[(R)-(4-propan-2-yloxyphenyl)-[4-(trifluoromethoxy)phenyl]methyl]piperazine;dihydrochloride
CID 171280875
2-piperazin-1-yl-1-(4-propan-2-yloxyphenyl)ethanone
CID 82263317
1-[2-(3,5-difluorophenyl)propan-2-yl]piperazine
CID 82292772
4-[2-(4-propan-2-yloxyphenyl)ethyl]piperidine
CID 22750908
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 1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine?
The IUPAC name of 1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine (CID 82303005) is 1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine.
What is the SMILES notation for 1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine?
The canonical SMILES for 1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine is CC(C)Oc1ccc(C(C)(C)N2CCNCC2)cc1.
What is the InChIKey of 1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine?
The InChIKey is DPFWONROXROFBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-13(2)19-15-7-5-14(6-8-15)16(3,4)18-11-9-17-10-12-18/h5-8,13,17H,9-12H2,1-4H3.
What are the key properties of 1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine?
1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine has a molecular weight of 262.40 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-propan-2-yloxyphenyl)propan-2-yl]piperazine is sourced from PubChem (CID 82303005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).