3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine

C10H14F3N3 — CID 105492309

IUPAC3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine
SMILESCc1[nH]c(C2CCCNC2)nc1C(F)(F)F
InChIInChI=1S/C10H14F3N3/c1-6-8(10(11,12)13)16-9(15-6)7-3-2-4-14-5-7/h7,14H,2-5H2,1H3,(H,15,16)
InChIKeyPUZDRPFJSUDHTI-UHFFFAOYSA-N
MW233.24 g/mol
LogP2.20
Rot. Bonds1

About 3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine

3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine (PubChem CID 105492309) has the molecular formula C10H14F3N3 and a molecular weight of 233.24 g/mol. Its IUPAC name is 3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine.

Molecular Properties

Compound Name3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine
PubChem CID105492309
Molecular FormulaC10H14F3N3
Molecular Weight233.24 g/mol
Exact Mass233.11
IUPAC Name3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine
SMILESCc1[nH]c(C2CCCNC2)nc1C(F)(F)F
InChIInChI=1S/C10H14F3N3/c1-6-8(10(11,12)13)16-9(15-6)7-3-2-4-14-5-7/h7,14H,2-5H2,1H3,(H,15,16)
InChIKeyPUZDRPFJSUDHTI-UHFFFAOYSA-N
XLogP2.20
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.24
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4,5-dimethyl-1H-imidazol-2-yl)piperidine
CID 43650978
2-methoxy-5-piperidin-3-yl-4-(trifluoromethyl)pyrimidine
CID 82666009
4-(azetidin-3-yl)-2-cyclobutyl-5-methyl-1H-imidazole
CID 105445538
2-piperidin-3-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole
CID 115018775
6-piperidin-3-yl-5H-imidazo[4,5-c]pyridazine
CID 112710709
3-(3-chloro-1H-1,2,4-triazol-5-yl)piperidine
CID 84660806
3-[3-(trichloromethyl)-1H-1,2,4-triazol-5-yl]piperidine
CID 82569188
5-methoxy-2-piperidin-3-yl-1H-imidazo[4,5-b]pyridine
CID 65483260
(3R)-3-(5-tert-butyl-1H-imidazol-2-yl)piperidine
CID 93256100
4,6-dimethyl-5-piperidin-3-yl-1H-pyrimidine-2-thione
CID 105481259
4-tert-butyl-5-ethyl-2-pyrrolidin-3-yl-1H-imidazole
CID 105478440
2-[(3S)-piperidin-3-yl]-1H-benzimidazole;dihydrochloride
CID 131870823

Frequently Asked Questions

What is the IUPAC name of 3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine?
The IUPAC name of 3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine (CID 105492309) is 3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine.
What is the SMILES notation for 3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine?
The canonical SMILES for 3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine is Cc1[nH]c(C2CCCNC2)nc1C(F)(F)F.
What is the InChIKey of 3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine?
The InChIKey is PUZDRPFJSUDHTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3/c1-6-8(10(11,12)13)16-9(15-6)7-3-2-4-14-5-7/h7,14H,2-5H2,1H3,(H,15,16).
What are the key properties of 3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine?
3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine has a molecular weight of 233.24 g/mol, XLogP of 2.20, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]piperidine is sourced from PubChem (CID 105492309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).