3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine

C22H26N4 — CID 95552633

IUPAC3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine
SMILESC[C@H](c1ccccc1)c1nccn1C1CCN(Cc2cccnc2)CC1
InChIInChI=1S/C22H26N4/c1-18(20-7-3-2-4-8-20)22-24-12-15-26(22)21-9-13-25(14-10-21)17-19-6-5-11-23-16-19/h2-8,11-12,15-16,18,21H,9-10,13-14,17H2,1H3/t18-/m1/s1
InChIKeyRBEJIRJUAVBVPO-GOSISDBHSA-N
MW346.48 g/mol
LogP4.27
Rot. Bonds5

About 3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine

3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine (PubChem CID 95552633) has the molecular formula C22H26N4 and a molecular weight of 346.48 g/mol. Its IUPAC name is 3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine.

Molecular Properties

Compound Name3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine
PubChem CID95552633
Molecular FormulaC22H26N4
Molecular Weight346.48 g/mol
Exact Mass346.22
IUPAC Name3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine
SMILESC[C@H](c1ccccc1)c1nccn1C1CCN(Cc2cccnc2)CC1
InChIInChI=1S/C22H26N4/c1-18(20-7-3-2-4-8-20)22-24-12-15-26(22)21-9-13-25(14-10-21)17-19-6-5-11-23-16-19/h2-8,11-12,15-16,18,21H,9-10,13-14,17H2,1H3/t18-/m1/s1
InChIKeyRBEJIRJUAVBVPO-GOSISDBHSA-N
XLogP4.27
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.48
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine with MolForge

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Related Compounds

1-[(2R)-2-phenylpropyl]-4-(pyridin-3-ylmethyl)-1,4-diazepane
CID 95718209
3-[[4-(3,5-dimethylpiperidin-1-yl)piperidin-1-yl]methyl]pyridine
CID 2911232
(2R,6S)-2,6-dimethyl-4-[1-(pyridin-3-ylmethyl)piperidin-4-yl]morpholine
CID 756436
3-[[4-[(2-phenylimidazol-1-yl)methyl]piperidin-1-yl]methyl]pyridine
CID 90494491
2-benzyl-6-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyridine
CID 95809192
oxalic acid;1-[1-(pyridin-3-ylmethyl)piperidin-4-yl]azepane
CID 2912313
3-[[3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrrolidin-1-yl]methyl]pyridine
CID 91916522
5-ethyl-2-[(3R)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrrolidin-1-yl]pyrimidine
CID 25289570
(2R)-2-amino-N-[1-(pyridin-3-ylmethyl)piperidin-4-yl]propanamide;hydrochloride
CID 120872926
N-[(S)-furan-2-yl(phenyl)methyl]-1-(pyridin-3-ylmethyl)piperidin-4-amine
CID 97229376
N-[(R)-furan-2-yl(phenyl)methyl]-1-(pyridin-3-ylmethyl)piperidin-4-amine
CID 97229377
N-[(1S)-1-(3-chlorophenyl)ethyl]-1-(pyridin-3-ylmethyl)piperidin-4-amine
CID 124588776

Frequently Asked Questions

What is the IUPAC name of 3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine?
The IUPAC name of 3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine (CID 95552633) is 3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine.
What is the SMILES notation for 3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine?
The canonical SMILES for 3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine is C[C@H](c1ccccc1)c1nccn1C1CCN(Cc2cccnc2)CC1.
What is the InChIKey of 3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine?
The InChIKey is RBEJIRJUAVBVPO-GOSISDBHSA-N. The full InChI is InChI=1S/C22H26N4/c1-18(20-7-3-2-4-8-20)22-24-12-15-26(22)21-9-13-25(14-10-21)17-19-6-5-11-23-16-19/h2-8,11-12,15-16,18,21H,9-10,13-14,17H2,1H3/t18-/m1/s1.
What are the key properties of 3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine?
3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine has a molecular weight of 346.48 g/mol, XLogP of 4.27, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-[2-[(1R)-1-phenylethyl]imidazol-1-yl]piperidin-1-yl]methyl]pyridine is sourced from PubChem (CID 95552633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).