3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol

C19H19ClN4O — CID 142070538

IUPAC3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol
SMILESOc1cc(Cl)cc(-c2cnc(C3CCN(c4ccccn4)CC3)[nH]2)c1
InChIInChI=1S/C19H19ClN4O/c20-15-9-14(10-16(25)11-15)17-12-22-19(23-17)13-4-7-24(8-5-13)18-3-1-2-6-21-18/h1-3,6,9-13,25H,4-5,7-8H2,(H,22,23)
InChIKeyBWAIKWQWFMUEGQ-UHFFFAOYSA-N
MW354.84 g/mol
LogP4.21
Rot. Bonds3

About 3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol

3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol (PubChem CID 142070538) has the molecular formula C19H19ClN4O and a molecular weight of 354.84 g/mol. Its IUPAC name is 3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol.

Molecular Properties

Compound Name3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol
PubChem CID142070538
Molecular FormulaC19H19ClN4O
Molecular Weight354.84 g/mol
Exact Mass354.12
IUPAC Name3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol
SMILESOc1cc(Cl)cc(-c2cnc(C3CCN(c4ccccn4)CC3)[nH]2)c1
InChIInChI=1S/C19H19ClN4O/c20-15-9-14(10-16(25)11-15)17-12-22-19(23-17)13-4-7-24(8-5-13)18-3-1-2-6-21-18/h1-3,6,9-13,25H,4-5,7-8H2,(H,22,23)
InChIKeyBWAIKWQWFMUEGQ-UHFFFAOYSA-N
XLogP4.21
TPSA65.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.84
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[5-[3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]piperidin-1-yl]pyridine
CID 10156114
2-phenoxy-5-[2-(1-pyridazin-3-ylpiperidin-4-yl)-1H-imidazol-5-yl]pyrimidine
CID 67362079
(6-chloro-3,4-dihydro-2H-quinoxalin-1-yl)-(1-pyridin-2-ylpiperidin-4-yl)methanone
CID 162652318
1-[(5-phenyl-1H-imidazol-2-yl)methyl]-4-pyridin-2-ylpiperazine
CID 10193294
2-chloro-N-(1-pyridin-2-ylpiperidin-4-yl)pyridin-3-amine
CID 43782400
4-[5-[4-fluoro-3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]-1-[4-(2-piperidin-4-yl-1H-imidazol-5-yl)-2-(trifluoromethyl)phenyl]piperidine
CID 134836577
4-[4-[5-[4-chloro-3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]piperidin-1-yl]-1H-pyrazolo[5,4-d]pyrimidine;hydrochloride
CID 90169604
1-(1-pyridin-2-ylpiperidin-4-yl)ethanone
CID 63845661
O-(1-pyridin-2-ylpiperidin-4-yl)hydroxylamine
CID 129267399
5-fluoro-4-[4-[5-[4-fluoro-3-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]piperidin-1-yl]-7H-pyrrolo[2,3-d]pyrimidine;hydrochloride
CID 90169685
5-(3-bromophenyl)-2-cyclopropyl-1H-imidazole
CID 89481039
4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol
CID 116881267

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol?
The IUPAC name of 3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol (CID 142070538) is 3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol.
What is the SMILES notation for 3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol?
The canonical SMILES for 3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol is Oc1cc(Cl)cc(-c2cnc(C3CCN(c4ccccn4)CC3)[nH]2)c1.
What is the InChIKey of 3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol?
The InChIKey is BWAIKWQWFMUEGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN4O/c20-15-9-14(10-16(25)11-15)17-12-22-19(23-17)13-4-7-24(8-5-13)18-3-1-2-6-21-18/h1-3,6,9-13,25H,4-5,7-8H2,(H,22,23).
What are the key properties of 3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol?
3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol has a molecular weight of 354.84 g/mol, XLogP of 4.21, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-[2-(1-pyridin-2-ylpiperidin-4-yl)-1H-imidazol-5-yl]phenol is sourced from PubChem (CID 142070538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).