6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile

C23H26N4O2 — CID 72838338

IUPAC6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile
SMILESN#Cc1cccc(N2CCC(Oc3ccccc3C(=O)N3CCCCC3)CC2)n1
InChIInChI=1S/C23H26N4O2/c24-17-18-7-6-10-22(25-18)26-15-11-19(12-16-26)29-21-9-3-2-8-20(21)23(28)27-13-4-1-5-14-27/h2-3,6-10,19H,1,4-5,11-16H2
InChIKeyFWESAXZQNVERNE-UHFFFAOYSA-N
MW390.49 g/mol
LogP3.63
Rot. Bonds4

About 6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile

6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile (PubChem CID 72838338) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is 6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile
PubChem CID72838338
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC Name6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile
SMILESN#Cc1cccc(N2CCC(Oc3ccccc3C(=O)N3CCCCC3)CC2)n1
InChIInChI=1S/C23H26N4O2/c24-17-18-7-6-10-22(25-18)26-15-11-19(12-16-26)29-21-9-3-2-8-20(21)23(28)27-13-4-1-5-14-27/h2-3,6-10,19H,1,4-5,11-16H2
InChIKeyFWESAXZQNVERNE-UHFFFAOYSA-N
XLogP3.63
TPSA69.46 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-[4-[4-(pyrrolidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile
CID 72855974
piperidin-1-yl-[2-[1-(1,3-thiazol-2-yl)piperidin-4-yl]oxyphenyl]methanone
CID 72846007
N-[1-(6-cyano-2-pyridinyl)piperidin-4-yl]cyclobutanecarboxamide
CID 163357560
[2-[1-(5-methyl-1,2-oxazole-3-carbonyl)piperidin-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone
CID 72865582
[2-[1-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]piperidin-4-yl]oxyphenyl]-piperidin-1-ylmethanone
CID 72929961
1-[1-(6-cyano-2-pyridinyl)piperidin-4-yl]-3-cyclohexylurea
CID 133392231
[2-[1-(cyclopentylmethyl)piperidin-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone
CID 26405720
6-(4-acetyl-1,4-diazepan-1-yl)pyridine-2-carbonitrile
CID 64594721
[2-[1-[(2-chlorophenyl)methyl]piperidin-4-yl]oxyphenyl]-piperidin-1-ylmethanone
CID 42150850
[2-[1-[(2,3-difluorophenyl)methyl]piperidin-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone
CID 42191016
6-(4-aminopiperidin-1-yl)pyridine-2-carbonitrile
CID 64587586
[2-[1-[(4-ethylphenyl)methyl]piperidin-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone
CID 25385116

Frequently Asked Questions

What is the IUPAC name of 6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile?
The IUPAC name of 6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile (CID 72838338) is 6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile.
What is the SMILES notation for 6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile?
The canonical SMILES for 6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile is N#Cc1cccc(N2CCC(Oc3ccccc3C(=O)N3CCCCC3)CC2)n1.
What is the InChIKey of 6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile?
The InChIKey is FWESAXZQNVERNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c24-17-18-7-6-10-22(25-18)26-15-11-19(12-16-26)29-21-9-3-2-8-20(21)23(28)27-13-4-1-5-14-27/h2-3,6-10,19H,1,4-5,11-16H2.
What are the key properties of 6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile?
6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile has a molecular weight of 390.49 g/mol, XLogP of 3.63, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[2-(piperidine-1-carbonyl)phenoxy]piperidin-1-yl]pyridine-2-carbonitrile is sourced from PubChem (CID 72838338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).