4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine

C62H70F10N12 — CID 157252680

IUPAC4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine
SMILESCn1c(-c2cc(F)cc(F)c2)cnc1C1CCNCC1.Cn1c(-c2cccc(C(F)(F)F)c2)cnc1C1CCNCC1.Cn1cc(-c2cc(F)cc(F)c2)nc1C1CCNCC1.Cn1cc(-c2cccc(C(F)(F)F)c2)nc1C1CCNCC1
InChIInChI=1S/2C16H18F3N3.2C15H17F2N3/c1-22-10-14(21-15(22)11-5-7-20-8-6-11)12-3-2-4-13(9-12)16(17,18)19;1-22-14(10-21-15(22)11-5-7-20-8-6-11)12-3-2-4-13(9-12)16(17,18)19;1-20-9-14(11-6-12(16)8-13(17)7-11)19-15(20)10-2-4-18-5-3-10;1-20-14(11-6-12(16)8-13(17)7-11)9-19-15(20)10-2-4-18-5-3-10/h2*2-4,9-11,20H,5-8H2,1H3;2*6-10,18H,2-5H2,1H3
InChIKeyAWNCYEHVPHCCES-UHFFFAOYSA-N
MW1173.31 g/mol
LogP12.81
Rot. Bonds8

About 4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine

4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine (PubChem CID 157252680) has the molecular formula C62H70F10N12 and a molecular weight of 1173.31 g/mol. Its IUPAC name is 4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine.

Molecular Properties

Compound Name4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine
PubChem CID157252680
Molecular FormulaC62H70F10N12
Molecular Weight1173.31 g/mol
Exact Mass1172.57
IUPAC Name4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine
SMILESCn1c(-c2cc(F)cc(F)c2)cnc1C1CCNCC1.Cn1c(-c2cccc(C(F)(F)F)c2)cnc1C1CCNCC1.Cn1cc(-c2cc(F)cc(F)c2)nc1C1CCNCC1.Cn1cc(-c2cccc(C(F)(F)F)c2)nc1C1CCNCC1
InChIInChI=1S/2C16H18F3N3.2C15H17F2N3/c1-22-10-14(21-15(22)11-5-7-20-8-6-11)12-3-2-4-13(9-12)16(17,18)19;1-22-14(10-21-15(22)11-5-7-20-8-6-11)12-3-2-4-13(9-12)16(17,18)19;1-20-9-14(11-6-12(16)8-13(17)7-11)19-15(20)10-2-4-18-5-3-10;1-20-14(11-6-12(16)8-13(17)7-11)9-19-15(20)10-2-4-18-5-3-10/h2*2-4,9-11,20H,5-8H2,1H3;2*6-10,18H,2-5H2,1H3
InChIKeyAWNCYEHVPHCCES-UHFFFAOYSA-N
XLogP12.81
TPSA119.40 Ų
H-Bond Donors4
H-Bond Acceptors12
Rotatable Bonds8
Heavy Atoms84
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001173.31
LogP ≤ 512.81
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1012

Analyze 4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine with MolForge

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Related Compounds

L-790070
CID 9806182
4-[5-[2-(1-phenyl-ethylamino)-pyrimidin-4-yl]-1-methyl-4-(3-trifluoromethylphenyl)-1H-imidazol-2-yl]-piperidine
CID 447721
{4-[3-Methyl-2-piperidin-4-yl-5-(3-trifluoromethyl-phenyl)-3H-imidazol-4-yl]-pyrimidin-2-yl}-((R)-1-phenyl-ethyl)-amine
CID 656907
6-{4-[4-(4-Fluoro-3-trifluoromethyl-phenyl)-1-methyl-1H-imidazol-2-yl]-piperidin-1-yl}-[5,5']bipyrimidinyl-4-ylamine
CID 89450695
5-(4-Fluorophenyl)-6-[4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(2-piperidin-1-ylethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-4-amine
CID 89450703
5-(4-Fluorophenyl)-6-[4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(2-pyrrolidin-1-ylethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-4-amine
CID 89450704
4-[3-methyl-2-piperidin-4-yl-5-[3-(trifluoromethyl)phenyl]imidazol-4-yl]-N-(1-phenylethyl)pyridin-2-amine
CID 18704766
5-Ethyl-6-[4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1-piperidin-4-ylimidazol-2-yl]piperidin-1-yl]pyrimidin-4-amine
CID 71516738
6-{4-[1-(2-Dimethylamino-ethyl)-4-(4-fluoro-3-trifluoromethyl-phenyl)-1H-imidazol-2-yl]-piperidin-1-yl}-5-pyridin-4-yl-pyrimidin-4-ylamine
CID 89442705
6-{4-[4-(4-Fluoro-3-trifluoromethyl-phenyl)-1-methyl-1H-imidazol-2-yl]-piperidin-1-yl}-5-(6-piperazin-1-yl-pyridin-3-yl)-pyrimidin-4-ylamine
CID 89442794
6'-{4-[4-(4-Fluoro-3-trifluoromethyl-phenyl)-1-methyl-1H-imidazol-2-yl]-piperidin-1-yl}-[5,5']bipyrimidinyl-2,4'-diamine
CID 89445411
5-Ethenyl-6-[4-[4-[4-fluoro-3-(trifluoromethyl)phenyl]-1-(2-piperidin-1-ylethyl)imidazol-2-yl]piperidin-1-yl]pyrimidin-4-amine
CID 89445538

Frequently Asked Questions

What is the IUPAC name of 4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine?
The IUPAC name of 4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine (CID 157252680) is 4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine.
What is the SMILES notation for 4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine?
The canonical SMILES for 4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine is Cn1c(-c2cc(F)cc(F)c2)cnc1C1CCNCC1.Cn1c(-c2cccc(C(F)(F)F)c2)cnc1C1CCNCC1.Cn1cc(-c2cc(F)cc(F)c2)nc1C1CCNCC1.Cn1cc(-c2cccc(C(F)(F)F)c2)nc1C1CCNCC1.
What is the InChIKey of 4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine?
The InChIKey is AWNCYEHVPHCCES-UHFFFAOYSA-N. The full InChI is InChI=1S/2C16H18F3N3.2C15H17F2N3/c1-22-10-14(21-15(22)11-5-7-20-8-6-11)12-3-2-4-13(9-12)16(17,18)19;1-22-14(10-21-15(22)11-5-7-20-8-6-11)12-3-2-4-13(9-12)16(17,18)19;1-20-9-14(11-6-12(16)8-13(17)7-11)19-15(20)10-2-4-18-5-3-10;1-20-14(11-6-12(16)8-13(17)7-11)9-19-15(20)10-2-4-18-5-3-10/h2*2-4,9-11,20H,5-8H2,1H3;2*6-10,18H,2-5H2,1H3.
What are the key properties of 4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine?
4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine has a molecular weight of 1173.31 g/mol, XLogP of 12.81, 8 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[5-(3,5-difluorophenyl)-1-methylimidazol-2-yl]piperidine;4-[1-methyl-4-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine;4-[1-methyl-5-[3-(trifluoromethyl)phenyl]imidazol-2-yl]piperidine is sourced from PubChem (CID 157252680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).