1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine

C16H22N4O — CID 58996743

IUPAC1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine
SMILESCN1CCN(c2ccccc2OCc2nccn2C)CC1
InChIInChI=1S/C16H22N4O/c1-18-9-11-20(12-10-18)14-5-3-4-6-15(14)21-13-16-17-7-8-19(16)2/h3-8H,9-13H2,1-2H3
InChIKeyISZNAMQEEBRATE-UHFFFAOYSA-N
MW286.38 g/mol
LogP1.75
Rot. Bonds4

About 1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine

1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine (PubChem CID 58996743) has the molecular formula C16H22N4O and a molecular weight of 286.38 g/mol. Its IUPAC name is 1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine.

Molecular Properties

Compound Name1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine
PubChem CID58996743
Molecular FormulaC16H22N4O
Molecular Weight286.38 g/mol
Exact Mass286.18
IUPAC Name1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine
SMILESCN1CCN(c2ccccc2OCc2nccn2C)CC1
InChIInChI=1S/C16H22N4O/c1-18-9-11-20(12-10-18)14-5-3-4-6-15(14)21-13-16-17-7-8-19(16)2/h3-8H,9-13H2,1-2H3
InChIKeyISZNAMQEEBRATE-UHFFFAOYSA-N
XLogP1.75
TPSA33.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-4-(2-phenylmethoxyphenyl)piperazine
CID 58996693
1-methyl-4-[2-(2-pyrrolidin-1-ylethoxy)phenyl]piperazine
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1-methyl-4-[2-(trifluoromethoxy)phenyl]piperazine
CID 167238583
2-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]benzonitrile
CID 23852101
1-methyl-4-[2-[(3-nitrophenyl)methoxy]phenyl]piperazine
CID 67725452
1-[2-[(2-ethylimidazol-1-yl)methyl]phenyl]-4-methylpiperazine
CID 58996638
2-[(2-tert-butyl-3-fluorophenoxy)methyl]-1-methylimidazole
CID 122606420
ethanol;1-methyl-2-[[6,13,20-trimethoxy-12,19-bis[(1-methylimidazol-2-yl)methoxy]-5-tetracyclo[15.4.0.03,8.010,15]henicosa-1(21),3,5,7,10,12,14,17,19-nonaenyl]oxymethyl]imidazole
CID 139144903
2-[(2-piperazin-1-ylphenoxy)methyl]pyrimidine
CID 62700527
5-fluoro-2-[(1-methylimidazol-2-yl)methoxy]benzoic acid
CID 71741821
N-[(2R)-1-[2-(4-methylpiperazin-1-yl)phenoxy]propan-2-yl]methanesulfonamide
CID 58817392
1-[2-(pyrimidin-2-ylmethoxy)phenyl]piperidin-4-amine
CID 62697897

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine?
The IUPAC name of 1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine (CID 58996743) is 1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine.
What is the SMILES notation for 1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine?
The canonical SMILES for 1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine is CN1CCN(c2ccccc2OCc2nccn2C)CC1.
What is the InChIKey of 1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine?
The InChIKey is ISZNAMQEEBRATE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O/c1-18-9-11-20(12-10-18)14-5-3-4-6-15(14)21-13-16-17-7-8-19(16)2/h3-8H,9-13H2,1-2H3.
What are the key properties of 1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine?
1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine has a molecular weight of 286.38 g/mol, XLogP of 1.75, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[2-[(1-methylimidazol-2-yl)methoxy]phenyl]piperazine is sourced from PubChem (CID 58996743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).