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

C19H25FN4 — CID 119932633

IUPAC4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine
SMILESFc1ccc(-c2cnc(C3CCCN3CC3CCNCC3)[nH]2)cc1
InChIInChI=1S/C19H25FN4/c20-16-5-3-15(4-6-16)17-12-22-19(23-17)18-2-1-11-24(18)13-14-7-9-21-10-8-14/h3-6,12,14,18,21H,1-2,7-11,13H2,(H,22,23)
InChIKeyFWZVKBDVGHCMBN-UHFFFAOYSA-N
MW328.43 g/mol
LogP3.35
Rot. Bonds4

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

4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine (PubChem CID 119932633) has the molecular formula C19H25FN4 and a molecular weight of 328.43 g/mol. Its IUPAC name is 4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine.

Molecular Properties

Compound Name4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine
PubChem CID119932633
Molecular FormulaC19H25FN4
Molecular Weight328.43 g/mol
Exact Mass328.21
IUPAC Name4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine
SMILESFc1ccc(-c2cnc(C3CCCN3CC3CCNCC3)[nH]2)cc1
InChIInChI=1S/C19H25FN4/c20-16-5-3-15(4-6-16)17-12-22-19(23-17)18-2-1-11-24(18)13-14-7-9-21-10-8-14/h3-6,12,14,18,21H,1-2,7-11,13H2,(H,22,23)
InChIKeyFWZVKBDVGHCMBN-UHFFFAOYSA-N
XLogP3.35
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.43
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[2-(4-methylphenyl)pyrrolidin-1-yl]methyl]piperidine
CID 119930010
[(2S)-2-[5-[4-[4-[2-(1-phosphanylpyrrolidin-2-yl)-1H-imidazol-5-yl]phenyl]phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]phosphane
CID 126554399
4-[[2-(3-fluorophenyl)pyrrolidin-1-yl]methyl]piperidine;hydrochloride
CID 119930248
2-cyclopropyl-5-(4-fluorophenyl)-1H-imidazole
CID 90241425
5-[2-[(2S)-1-methylpyrrolidin-2-yl]-1H-imidazol-5-yl]-2-[4-[2-[(2S)-1-methylpyrrolidin-2-yl]-1H-imidazol-5-yl]phenyl]pyrimidine
CID 143630216
2-phenyl-1-(piperidin-4-ylmethyl)piperidine
CID 120847720
2-amino-4-[(2S)-2-[5-[4-[4-[2-[(2S)-1-(3-amino-2-methyl-4-oxobutyl)pyrrolidin-2-yl]-1H-imidazol-5-yl]phenyl]phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-3-methylbutanal
CID 87525715
(3R)-4-(cyclopropylmethyl)-3-[5-(2,4-difluorophenyl)-1H-imidazol-2-yl]morpholine
CID 71694155
1-[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]piperidin-1-yl]-2-methylsulfanylpropan-1-one
CID 138046241
(2S)-2-[5-(4-cyanophenyl)-1H-imidazol-2-yl]pyrrolidine-1-carboxylic acid
CID 90259688
4-[2-[1-(2-methylsulfanylpropyl)piperidin-2-yl]-1H-imidazol-5-yl]pyridine
CID 174162673
(3R)-4-(cyclopropylmethyl)-3-(5-pyridin-3-yl-1H-imidazol-2-yl)morpholine
CID 71694177

Frequently Asked Questions

What is the IUPAC name of 4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine?
The IUPAC name of 4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine (CID 119932633) is 4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine.
What is the SMILES notation for 4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine?
The canonical SMILES for 4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine is Fc1ccc(-c2cnc(C3CCCN3CC3CCNCC3)[nH]2)cc1.
What is the InChIKey of 4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine?
The InChIKey is FWZVKBDVGHCMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25FN4/c20-16-5-3-15(4-6-16)17-12-22-19(23-17)18-2-1-11-24(18)13-14-7-9-21-10-8-14/h3-6,12,14,18,21H,1-2,7-11,13H2,(H,22,23).
What are the key properties of 4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine?
4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine has a molecular weight of 328.43 g/mol, XLogP of 3.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]methyl]piperidine is sourced from PubChem (CID 119932633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).