2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile

C14H16N2O2 — CID 14024161

IUPAC2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile
SMILESN#Cc1cc(C2CCCO2)nc(C2CCCO2)c1
InChIInChI=1S/C14H16N2O2/c15-9-10-7-11(13-3-1-5-17-13)16-12(8-10)14-4-2-6-18-14/h7-8,13-14H,1-6H2
InChIKeySSAXWRFADKDUPA-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.66
Rot. Bonds2

About 2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile

2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile (PubChem CID 14024161) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile.

Molecular Properties

Compound Name2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile
PubChem CID14024161
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile
SMILESN#Cc1cc(C2CCCO2)nc(C2CCCO2)c1
InChIInChI=1S/C14H16N2O2/c15-9-10-7-11(13-3-1-5-17-13)16-12(8-10)14-4-2-6-18-14/h7-8,13-14H,1-6H2
InChIKeySSAXWRFADKDUPA-UHFFFAOYSA-N
XLogP2.66
TPSA55.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(oxolan-2-yl)-3H-benzimidazole-5-carbonitrile
CID 79004157
4-chloro-2-(chloromethyl)-6-(oxolan-2-yl)pyrimidine
CID 102538380
2-(hydroxymethyl)-4-(oxolan-2-yl)-1H-pyrimidin-6-one
CID 137191445
4-chloro-2-methyl-6-[(2S)-oxan-2-yl]pyridine
CID 162412127
4-[(2R)-oxolan-2-yl]-1,3-thiazol-2-amine
CID 86336609
4-(oxolan-2-yl)oxadiazole
CID 155756493
2-(chloromethyl)-4-[(2S)-oxolan-2-yl]-1H-pyrimidin-6-one
CID 137119603
N-(3-cyanophenoxy)-2-(oxolan-2-yl)-1,3-thiazole-4-carboxamide
CID 166249191
2-[1-methyl-3-[(2R)-oxolan-2-yl]pyrazol-5-yl]oxybenzonitrile
CID 168770755
3-bromo-2-methyl-6-(oxolan-2-yl)pyridine
CID 172992725
4-(oxan-2-yl)-1,3-thiazole
CID 91346575
2-(difluoromethyl)-6-(oxolan-2-yl)pyridine
CID 152696540

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile?
The IUPAC name of 2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile (CID 14024161) is 2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile.
What is the SMILES notation for 2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile?
The canonical SMILES for 2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile is N#Cc1cc(C2CCCO2)nc(C2CCCO2)c1.
What is the InChIKey of 2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile?
The InChIKey is SSAXWRFADKDUPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c15-9-10-7-11(13-3-1-5-17-13)16-12(8-10)14-4-2-6-18-14/h7-8,13-14H,1-6H2.
What are the key properties of 2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile?
2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile has a molecular weight of 244.29 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(oxolan-2-yl)pyridine-4-carbonitrile is sourced from PubChem (CID 14024161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).