(3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine

C15H20N4 — CID 106553924

IUPAC(3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine
SMILESCc1cn(-c2ccccc2)c(N2CCN[C@H](C)C2)n1
InChIInChI=1S/C15H20N4/c1-12-10-18(9-8-16-12)15-17-13(2)11-19(15)14-6-4-3-5-7-14/h3-7,11-12,16H,8-10H2,1-2H3/t12-/m1/s1
InChIKeyBTJHWDYQNMWPOK-GFCCVEGCSA-N
MW256.35 g/mol
LogP1.98
Rot. Bonds2

About (3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine

(3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine (PubChem CID 106553924) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is (3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine.

Molecular Properties

Compound Name(3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine
PubChem CID106553924
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name(3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine
SMILESCc1cn(-c2ccccc2)c(N2CCN[C@H](C)C2)n1
InChIInChI=1S/C15H20N4/c1-12-10-18(9-8-16-12)15-17-13(2)11-19(15)14-6-4-3-5-7-14/h3-7,11-12,16H,8-10H2,1-2H3/t12-/m1/s1
InChIKeyBTJHWDYQNMWPOK-GFCCVEGCSA-N
XLogP1.98
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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(3R)-3-methyl-1-(4-phenylphenyl)piperazine
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2-[(3S)-3-methylpiperazin-1-yl]-1,3-benzothiazole
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3-methyl-6-(3-methylpiperazin-1-yl)pyridazine
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4-methyl-2-(3-methylpiperazin-1-yl)pyrimidine;hydrochloride
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2-(3-methylpiperazin-1-yl)-5-phenylpyrimidine
CID 116976426
3-methyl-1-(3-propan-2-ylphenyl)piperazine
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CID 62480503

Frequently Asked Questions

What is the IUPAC name of (3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine?
The IUPAC name of (3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine (CID 106553924) is (3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine.
What is the SMILES notation for (3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine?
The canonical SMILES for (3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine is Cc1cn(-c2ccccc2)c(N2CCN[C@H](C)C2)n1.
What is the InChIKey of (3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine?
The InChIKey is BTJHWDYQNMWPOK-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H20N4/c1-12-10-18(9-8-16-12)15-17-13(2)11-19(15)14-6-4-3-5-7-14/h3-7,11-12,16H,8-10H2,1-2H3/t12-/m1/s1.
What are the key properties of (3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine?
(3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine has a molecular weight of 256.35 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methyl-1-(4-methyl-1-phenylimidazol-2-yl)piperazine is sourced from PubChem (CID 106553924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).