1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine

C15H24N2O2 — CID 117415818

IUPAC1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine
SMILESCOc1cccc(OC(C)C)c1CN1CCNCC1
InChIInChI=1S/C15H24N2O2/c1-12(2)19-15-6-4-5-14(18-3)13(15)11-17-9-7-16-8-10-17/h4-6,12,16H,7-11H2,1-3H3
InChIKeyZBOBCDCRIDXNJF-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.89
Rot. Bonds5

About 1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine

1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine (PubChem CID 117415818) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine.

Molecular Properties

Compound Name1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine
PubChem CID117415818
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine
SMILESCOc1cccc(OC(C)C)c1CN1CCNCC1
InChIInChI=1S/C15H24N2O2/c1-12(2)19-15-6-4-5-14(18-3)13(15)11-17-9-7-16-8-10-17/h4-6,12,16H,7-11H2,1-3H3
InChIKeyZBOBCDCRIDXNJF-UHFFFAOYSA-N
XLogP1.89
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(2-methoxy-6-methylsulfanylphenyl)methyl]piperazine
CID 117384519
1-[(3-methoxy-2-methylphenyl)methyl]piperazine
CID 83707267
1-[2-(2-propan-2-yloxyphenoxy)ethyl]piperazine
CID 762602
1-(2-ethyl-3-methoxyphenyl)piperazine
CID 143239355
1-[3-(4-methoxy-3-propan-2-yloxyphenyl)propyl]piperazine
CID 82160589
1-[(5-methoxy-1,3-dihydro-2-benzofuran-4-yl)methyl]piperazine
CID 117374087
1-[(3-tert-butyl-4-propan-2-yloxyphenyl)methyl]piperazine
CID 82263845
2-(2-methoxy-6-propan-2-yloxyphenyl)-N-methylethanamine
CID 117320466
1-[2-(2-methoxyphenyl)propyl]-1,4-diazepane
CID 82086944
1-[(2S)-2-fluoro-2-(2-methoxyphenyl)ethyl]piperazine
CID 129493112
1-[(2,6-dichlorophenyl)methyl]piperazine
CID 770796
4-[1-(2-methoxyphenoxy)ethyl]piperidine
CID 105496691

Frequently Asked Questions

What is the IUPAC name of 1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine?
The IUPAC name of 1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine (CID 117415818) is 1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine.
What is the SMILES notation for 1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine?
The canonical SMILES for 1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine is COc1cccc(OC(C)C)c1CN1CCNCC1.
What is the InChIKey of 1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine?
The InChIKey is ZBOBCDCRIDXNJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-12(2)19-15-6-4-5-14(18-3)13(15)11-17-9-7-16-8-10-17/h4-6,12,16H,7-11H2,1-3H3.
What are the key properties of 1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine?
1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine has a molecular weight of 264.37 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methoxy-6-propan-2-yloxyphenyl)methyl]piperazine is sourced from PubChem (CID 117415818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).