2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine

C24H27N3O — CID 95809169

IUPAC2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine
SMILESCOc1ccccc1Cc1cccc(C2CCN(Cc3ccncc3)CC2)n1
InChIInChI=1S/C24H27N3O/c1-28-24-8-3-2-5-21(24)17-22-6-4-7-23(26-22)20-11-15-27(16-12-20)18-19-9-13-25-14-10-19/h2-10,13-14,20H,11-12,15-18H2,1H3
InChIKeyNTIAXGMXHNYPDF-UHFFFAOYSA-N
MW373.50 g/mol
LogP4.46
Rot. Bonds6

About 2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine

2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine (PubChem CID 95809169) has the molecular formula C24H27N3O and a molecular weight of 373.50 g/mol. Its IUPAC name is 2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine.

Molecular Properties

Compound Name2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine
PubChem CID95809169
Molecular FormulaC24H27N3O
Molecular Weight373.50 g/mol
Exact Mass373.22
IUPAC Name2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine
SMILESCOc1ccccc1Cc1cccc(C2CCN(Cc3ccncc3)CC2)n1
InChIInChI=1S/C24H27N3O/c1-28-24-8-3-2-5-21(24)17-22-6-4-7-23(26-22)20-11-15-27(16-12-20)18-19-9-13-25-14-10-19/h2-10,13-14,20H,11-12,15-18H2,1H3
InChIKeyNTIAXGMXHNYPDF-UHFFFAOYSA-N
XLogP4.46
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[6-[(2-methoxyphenyl)methyl]-2-pyridinyl]piperidin-1-yl]-phenylmethanone
CID 95808984
4-[6-[(2-methoxyphenyl)methyl]-2-pyridinyl]-N,N-dimethylpiperidine-1-sulfonamide
CID 95809660
2-[(2-chlorophenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
CID 110249365
2-[(2-methylphenyl)methyl]-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyridine
CID 95809282
2-[(2-methoxyphenyl)methyl]-6-[(2R)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyridine
CID 95817922
2-benzyl-6-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyridine
CID 95809192
2-(2-methoxyphenyl)-6-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
CID 110249357
2-[(3-methoxyphenyl)methyl]-6-[(3R)-1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
CID 95809167
N-[(3-methoxy-2-methylphenyl)methyl]-1-(pyridin-4-ylmethyl)piperidin-4-amine
CID 154803346
2-[(4-fluorophenyl)methyl]-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyridine
CID 95809288
4-chloro-1-[(2-methoxyphenyl)methyl]piperidine
CID 63389508
1-[4-[2-[6-[(2-methoxyphenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]piperidin-1-yl]ethanone
CID 110254712

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine?
The IUPAC name of 2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine (CID 95809169) is 2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine.
What is the SMILES notation for 2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine?
The canonical SMILES for 2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine is COc1ccccc1Cc1cccc(C2CCN(Cc3ccncc3)CC2)n1.
What is the InChIKey of 2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine?
The InChIKey is NTIAXGMXHNYPDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O/c1-28-24-8-3-2-5-21(24)17-22-6-4-7-23(26-22)20-11-15-27(16-12-20)18-19-9-13-25-14-10-19/h2-10,13-14,20H,11-12,15-18H2,1H3.
What are the key properties of 2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine?
2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine has a molecular weight of 373.50 g/mol, XLogP of 4.46, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine is sourced from PubChem (CID 95809169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).