4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine

C18H25N3 — CID 176967131

IUPAC4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine
SMILESCC(C)c1ccc(-c2cnc(C3CCNCC3)n2C)cc1
InChIInChI=1S/C18H25N3/c1-13(2)14-4-6-15(7-5-14)17-12-20-18(21(17)3)16-8-10-19-11-9-16/h4-7,12-13,16,19H,8-11H2,1-3H3
InChIKeyAFRLHIKOYKMQPT-UHFFFAOYSA-N
MW283.42 g/mol
LogP3.68
Rot. Bonds3

About 4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine

4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine (PubChem CID 176967131) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine.

Molecular Properties

Compound Name4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine
PubChem CID176967131
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine
SMILESCC(C)c1ccc(-c2cnc(C3CCNCC3)n2C)cc1
InChIInChI=1S/C18H25N3/c1-13(2)14-4-6-15(7-5-14)17-12-20-18(21(17)3)16-8-10-19-11-9-16/h4-7,12-13,16,19H,8-11H2,1-3H3
InChIKeyAFRLHIKOYKMQPT-UHFFFAOYSA-N
XLogP3.68
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[5-[4-fluoro-3-(trifluoromethyl)phenyl]-1-methylimidazol-2-yl]piperidine
CID 89442792
4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidin-4-ol
CID 176967150
4-[2-(4-propan-2-ylphenyl)-1H-imidazol-5-yl]piperidine
CID 82463539
2-piperidin-4-yl-1,5-di(propan-2-yl)benzimidazole
CID 82334138
1-[4-[4-(3-methyl-2-propan-2-ylimidazol-4-yl)phenyl]phenyl]ethanethiol
CID 134414104
1-(4-propan-2-ylphenyl)-5-pyrrolidin-3-ylimidazole
CID 114716402
1-piperidin-4-yl-6-propan-2-yl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole
CID 82167369
3-[5-(3-bromophenyl)-1-methylimidazol-2-yl]piperidine
CID 84604162
5-[3-methyl-2-(oxan-4-yl)imidazol-4-yl]pyrimidine
CID 171075062
4-(4-propan-2-yl-1,2,4-triazol-3-yl)piperidine
CID 50988293
(3R)-3-(4-propan-2-ylphenoxy)pyrrolidine
CID 26192167
cumene;4-methylpiperidine
CID 158684278

Frequently Asked Questions

What is the IUPAC name of 4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine?
The IUPAC name of 4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine (CID 176967131) is 4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine.
What is the SMILES notation for 4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine?
The canonical SMILES for 4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine is CC(C)c1ccc(-c2cnc(C3CCNCC3)n2C)cc1.
What is the InChIKey of 4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine?
The InChIKey is AFRLHIKOYKMQPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-13(2)14-4-6-15(7-5-14)17-12-20-18(21(17)3)16-8-10-19-11-9-16/h4-7,12-13,16,19H,8-11H2,1-3H3.
What are the key properties of 4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine?
4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine has a molecular weight of 283.42 g/mol, XLogP of 3.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-methyl-5-(4-propan-2-ylphenyl)imidazol-2-yl]piperidine is sourced from PubChem (CID 176967131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).