1-(2-propan-2-ylphenyl)piperazine

C13H20N2 — CID 3608822

IUPAC1-(2-propan-2-ylphenyl)piperazine
SMILESCC(C)c1ccccc1N1CCNCC1
InChIInChI=1S/C13H20N2/c1-11(2)12-5-3-4-6-13(12)15-9-7-14-8-10-15/h3-6,11,14H,7-10H2,1-2H3
InChIKeyJQQVFOBGUYOMQP-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.22
Rot. Bonds2

About 1-(2-propan-2-ylphenyl)piperazine

1-(2-propan-2-ylphenyl)piperazine (PubChem CID 3608822) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 1-(2-propan-2-ylphenyl)piperazine.

Molecular Properties

Compound Name1-(2-propan-2-ylphenyl)piperazine
PubChem CID3608822
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name1-(2-propan-2-ylphenyl)piperazine
SMILESCC(C)c1ccccc1N1CCNCC1
InChIInChI=1S/C13H20N2/c1-11(2)12-5-3-4-6-13(12)15-9-7-14-8-10-15/h3-6,11,14H,7-10H2,1-2H3
InChIKeyJQQVFOBGUYOMQP-UHFFFAOYSA-N
XLogP2.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-propan-2-ylphenyl)pyrrolidine
CID 10607693
5,5-dimethyl-1-(2-propan-2-ylphenyl)-1,4-diazepane
CID 117023755
1-(2-piperazin-1-ylphenyl)piperazine;hydrobromide
CID 118703673
aziridine;1,2-di(propan-2-yl)benzene
CID 88841585
4,4-difluoro-1-(2-propan-2-ylphenyl)piperidine
CID 117007764
(1S)-1-(2-piperazin-1-ylphenyl)ethane-1,2-diamine
CID 66517777
3-piperazin-1-yl-1-(2-propan-2-ylphenyl)pyrrolidine-2,5-dione
CID 54773621
4,4-dimethyl-1-(2-propan-2-ylphenyl)-1,5-diazocane
CID 117014652
1-(3-propan-2-yl-1-benzofuran-4-yl)piperazine
CID 82385549
3-methyl-1-(2-propan-2-ylphenyl)-1,4-diazocane
CID 117016339
(1-methylimidazol-2-yl)-(2-piperazin-1-ylphenyl)methanol
CID 58996635
3-(2-methylpropyl)-1-(2-propan-2-ylphenyl)piperazine
CID 64923787

Frequently Asked Questions

What is the IUPAC name of 1-(2-propan-2-ylphenyl)piperazine?
The IUPAC name of 1-(2-propan-2-ylphenyl)piperazine (CID 3608822) is 1-(2-propan-2-ylphenyl)piperazine.
What is the SMILES notation for 1-(2-propan-2-ylphenyl)piperazine?
The canonical SMILES for 1-(2-propan-2-ylphenyl)piperazine is CC(C)c1ccccc1N1CCNCC1.
What is the InChIKey of 1-(2-propan-2-ylphenyl)piperazine?
The InChIKey is JQQVFOBGUYOMQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-11(2)12-5-3-4-6-13(12)15-9-7-14-8-10-15/h3-6,11,14H,7-10H2,1-2H3.
What are the key properties of 1-(2-propan-2-ylphenyl)piperazine?
1-(2-propan-2-ylphenyl)piperazine has a molecular weight of 204.32 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-propan-2-ylphenyl)piperazine is sourced from PubChem (CID 3608822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).