3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine

C16H21N3O — CID 154817064

IUPAC3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine
SMILESCOc1cccc(-c2nccn2C2CCCN(C)C2)c1
InChIInChI=1S/C16H21N3O/c1-18-9-4-6-14(12-18)19-10-8-17-16(19)13-5-3-7-15(11-13)20-2/h3,5,7-8,10-11,14H,4,6,9,12H2,1-2H3
InChIKeyOSZDXQQONJMGLX-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.83
Rot. Bonds3

About 3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine

3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine (PubChem CID 154817064) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine.

Molecular Properties

Compound Name3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine
PubChem CID154817064
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine
SMILESCOc1cccc(-c2nccn2C2CCCN(C)C2)c1
InChIInChI=1S/C16H21N3O/c1-18-9-4-6-14(12-18)19-10-8-17-16(19)13-5-3-7-15(11-13)20-2/h3,5,7-8,10-11,14H,4,6,9,12H2,1-2H3
InChIKeyOSZDXQQONJMGLX-UHFFFAOYSA-N
XLogP2.83
TPSA30.29 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methoxyphenyl)-6-(1-methylpiperidin-3-yl)pyridine
CID 110249259
2-(3-methoxyphenyl)-5-[(3R)-1-methylpiperidin-3-yl]pyrazine
CID 95820925
1-bromo-2-(3-methoxyphenyl)imidazole
CID 175313145
3-[2-(2H-chromen-3-yl)imidazol-1-yl]-1-methylpiperidine
CID 154565849
1-(1-methylpiperidin-3-yl)imidazole-2-carbonitrile
CID 84732982
2-(3-iodophenyl)-1-(3-methylcyclohexyl)imidazole
CID 79787135
2-[4-[2-(2-methoxy-4-pyridinyl)imidazol-1-yl]piperidin-1-yl]pyrimidine
CID 154566004
2-[3-[2-(7-methoxy-1,3-benzodioxol-5-yl)imidazol-1-yl]piperidin-1-yl]pyrimidine
CID 70787827
(3-methoxyphenyl)-(1-methylpiperidin-3-yl)methanone
CID 82389965
5-chloro-3-(3-methoxyphenyl)imidazo[1,5-a]pyridine
CID 117142201
2-(4-methoxyphenyl)-6-(1-methylpiperidin-3-yl)pyridine
CID 110249260
1-[3-(1-cyclopropylimidazol-2-yl)phenyl]-N,N-dimethylmethanamine
CID 155919706

Frequently Asked Questions

What is the IUPAC name of 3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine?
The IUPAC name of 3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine (CID 154817064) is 3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine.
What is the SMILES notation for 3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine?
The canonical SMILES for 3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine is COc1cccc(-c2nccn2C2CCCN(C)C2)c1.
What is the InChIKey of 3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine?
The InChIKey is OSZDXQQONJMGLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-18-9-4-6-14(12-18)19-10-8-17-16(19)13-5-3-7-15(11-13)20-2/h3,5,7-8,10-11,14H,4,6,9,12H2,1-2H3.
What are the key properties of 3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine?
3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine has a molecular weight of 271.36 g/mol, XLogP of 2.83, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3-methoxyphenyl)imidazol-1-yl]-1-methylpiperidine is sourced from PubChem (CID 154817064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).