6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile

C15H17N3O2 — CID 122248667

IUPAC6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile
SMILESN#Cc1ccc(OC2CN(C(=O)C3CCCC3)C2)nc1
InChIInChI=1S/C15H17N3O2/c16-7-11-5-6-14(17-8-11)20-13-9-18(10-13)15(19)12-3-1-2-4-12/h5-6,8,12-13H,1-4,9-10H2
InChIKeyAYWJURMCXPYNLT-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.73
Rot. Bonds3

About 6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile

6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile (PubChem CID 122248667) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile
PubChem CID122248667
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile
SMILESN#Cc1ccc(OC2CN(C(=O)C3CCCC3)C2)nc1
InChIInChI=1S/C15H17N3O2/c16-7-11-5-6-14(17-8-11)20-13-9-18(10-13)15(19)12-3-1-2-4-12/h5-6,8,12-13H,1-4,9-10H2
InChIKeyAYWJURMCXPYNLT-UHFFFAOYSA-N
XLogP1.73
TPSA66.22 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(5-cyano-2-pyridinyl)oxy]-N-cyclohexylazetidine-1-carboxamide
CID 122248876
6-[1-(2-cyclohexylacetyl)azetidin-3-yl]oxypyridine-3-carbonitrile
CID 122248669
6-[1-(2-cyclopentylsulfanylacetyl)azetidin-3-yl]oxypyridine-3-carbonitrile
CID 122248602
ethyl 2-[3-[(5-cyano-2-pyridinyl)oxy]azetidin-1-yl]-2-oxoacetate
CID 122248678
6-[1-(2-ethoxyacetyl)azetidin-3-yl]oxypyridine-3-carbonitrile
CID 122248677
6-[1-[2-(2-chlorophenyl)acetyl]azetidin-3-yl]oxypyridine-3-carbonitrile
CID 122248816
3-[(5-cyano-2-pyridinyl)oxy]-N-(4-ethoxyphenyl)azetidine-1-carboxamide
CID 122248888
6-[1-(2-benzoylbenzoyl)azetidin-3-yl]oxypyridine-3-carbonitrile
CID 122248635
N-benzyl-3-[(5-cyano-2-pyridinyl)oxy]azetidine-1-carboxamide
CID 122248897
4-[[3-[(5-cyano-2-pyridinyl)oxy]pyrrolidine-1-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 122024721
6-[1-(2-benzylsulfanylacetyl)azetidin-3-yl]oxypyridine-3-carbonitrile
CID 122248760
3-[(5-cyano-2-pyridinyl)oxy]-N-(2-methylphenyl)azetidine-1-carboxamide
CID 122248920

Frequently Asked Questions

What is the IUPAC name of 6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile?
The IUPAC name of 6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile (CID 122248667) is 6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile.
What is the SMILES notation for 6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile?
The canonical SMILES for 6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile is N#Cc1ccc(OC2CN(C(=O)C3CCCC3)C2)nc1.
What is the InChIKey of 6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile?
The InChIKey is AYWJURMCXPYNLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c16-7-11-5-6-14(17-8-11)20-13-9-18(10-13)15(19)12-3-1-2-4-12/h5-6,8,12-13H,1-4,9-10H2.
What are the key properties of 6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile?
6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile has a molecular weight of 271.32 g/mol, XLogP of 1.73, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(cyclopentanecarbonyl)azetidin-3-yl]oxypyridine-3-carbonitrile is sourced from PubChem (CID 122248667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).