2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine

C15H20N4O — CID 114705840

IUPAC2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine
SMILESCOc1cc(Cn2cncc2C2CCCCN2)ccn1
InChIInChI=1S/C15H20N4O/c1-20-15-8-12(5-7-18-15)10-19-11-16-9-14(19)13-4-2-3-6-17-13/h5,7-9,11,13,17H,2-4,6,10H2,1H3
InChIKeyQRUAGTLIMMQUMB-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.15
Rot. Bonds4

About 2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine

2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine (PubChem CID 114705840) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine.

Molecular Properties

Compound Name2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine
PubChem CID114705840
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine
SMILESCOc1cc(Cn2cncc2C2CCCCN2)ccn1
InChIInChI=1S/C15H20N4O/c1-20-15-8-12(5-7-18-15)10-19-11-16-9-14(19)13-4-2-3-6-17-13/h5,7-9,11,13,17H,2-4,6,10H2,1H3
InChIKeyQRUAGTLIMMQUMB-UHFFFAOYSA-N
XLogP2.15
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(3-methoxyphenyl)methyl]-5-pyrrolidin-2-ylimidazole
CID 114704435
4-[[5-[(2S)-pyrrolidin-2-yl]imidazol-1-yl]methyl]pyridine
CID 104942141
1-[(4-methoxyphenyl)methyl]-5-pyrrolidin-2-ylimidazole
CID 114702895
1-[(4-methoxyphenyl)methyl]-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104941677
2-[3-(1H-pyrazol-4-ylmethyl)imidazol-4-yl]piperidine
CID 114705336
[3-[(2-methoxy-4-pyridinyl)methyl]imidazol-4-yl]methanol
CID 66150197
1-[(3-nitrophenyl)methyl]-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104942894
2-[3-(3-methoxypropyl)imidazol-4-yl]piperidine
CID 114703963
2-[3-[2-(3-methylphenoxy)ethyl]imidazol-4-yl]piperidine
CID 114704523
2-methoxy-5-(5-piperidin-2-ylimidazol-1-yl)pyridine
CID 114702661
N-[[3-[(2-methoxy-4-pyridinyl)methyl]imidazol-4-yl]methyl]propan-2-amine
CID 66151600
1-[2-(4-methoxyphenyl)ethyl]-5-pyrrolidin-2-ylimidazole
CID 114702887

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine?
The IUPAC name of 2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine (CID 114705840) is 2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine.
What is the SMILES notation for 2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine?
The canonical SMILES for 2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine is COc1cc(Cn2cncc2C2CCCCN2)ccn1.
What is the InChIKey of 2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine?
The InChIKey is QRUAGTLIMMQUMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-20-15-8-12(5-7-18-15)10-19-11-16-9-14(19)13-4-2-3-6-17-13/h5,7-9,11,13,17H,2-4,6,10H2,1H3.
What are the key properties of 2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine?
2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine has a molecular weight of 272.35 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-[(5-piperidin-2-ylimidazol-1-yl)methyl]pyridine is sourced from PubChem (CID 114705840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).