1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine

C15H20FN3 — CID 82023617

IUPAC1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine
SMILESFc1ccc(C(C2=NCCN2)N2CCCCC2)cc1
InChIInChI=1S/C15H20FN3/c16-13-6-4-12(5-7-13)14(15-17-8-9-18-15)19-10-2-1-3-11-19/h4-7,14H,1-3,8-11H2,(H,17,18)
InChIKeyROHLMJXBIWQCOZ-UHFFFAOYSA-N
MW261.34 g/mol
LogP2.35
Rot. Bonds3

About 1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine

1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine (PubChem CID 82023617) has the molecular formula C15H20FN3 and a molecular weight of 261.34 g/mol. Its IUPAC name is 1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine.

Molecular Properties

Compound Name1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine
PubChem CID82023617
Molecular FormulaC15H20FN3
Molecular Weight261.34 g/mol
Exact Mass261.16
IUPAC Name1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine
SMILESFc1ccc(C(C2=NCCN2)N2CCCCC2)cc1
InChIInChI=1S/C15H20FN3/c16-13-6-4-12(5-7-13)14(15-17-8-9-18-15)19-10-2-1-3-11-19/h4-7,14H,1-3,8-11H2,(H,17,18)
InChIKeyROHLMJXBIWQCOZ-UHFFFAOYSA-N
XLogP2.35
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.34
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4,5-dihydro-1H-imidazol-2-yl(phenyl)methyl]piperidine
CID 82023612
1-[(2-chlorophenyl)-(4-fluorophenyl)methyl]azetidine
CID 141103100
1-[(1-cyclopentyltetrazol-5-yl)-(4-fluorophenyl)methyl]piperidine
CID 3173834
6-[(4-fluorophenyl)-piperidin-1-ylmethyl]-2,3-dihydro-1H-inden-5-ol
CID 162643598
4-[bis(4-fluorophenyl)methyl]morpholine
CID 25146239
2-(azepan-1-yl)-2-(4-fluorophenyl)ethanamine
CID 6484142
9-[bis(4-fluorophenyl)methyl]-2,9-diazaspiro[5.5]undecan-1-one
CID 118962963
4-[bis(4-fluorophenyl)methyl]-N,N-dimethylpiperazine-1-sulfonamide
CID 35315029
2,4-ditert-butyl-6-[(4-fluorophenyl)-piperidin-1-ylmethyl]phenol
CID 22648340
[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-cyclohexylmethanone;hydrochloride
CID 155894968
1-(4-fluorophenyl)-2-pyrrolidin-1-ylpropan-1-amine
CID 16790834
2-(4-fluorophenyl)-2-pyrrolidin-1-ylacetamide
CID 82114619

Frequently Asked Questions

What is the IUPAC name of 1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine?
The IUPAC name of 1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine (CID 82023617) is 1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine.
What is the SMILES notation for 1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine?
The canonical SMILES for 1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine is Fc1ccc(C(C2=NCCN2)N2CCCCC2)cc1.
What is the InChIKey of 1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine?
The InChIKey is ROHLMJXBIWQCOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FN3/c16-13-6-4-12(5-7-13)14(15-17-8-9-18-15)19-10-2-1-3-11-19/h4-7,14H,1-3,8-11H2,(H,17,18).
What are the key properties of 1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine?
1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine has a molecular weight of 261.34 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4,5-dihydro-1H-imidazol-2-yl-(4-fluorophenyl)methyl]piperidine is sourced from PubChem (CID 82023617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).