6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile

C10H9N3O2 — CID 43822801

IUPAC6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile
SMILESN#Cc1ccc(NC2CCOC2=O)nc1
InChIInChI=1S/C10H9N3O2/c11-5-7-1-2-9(12-6-7)13-8-3-4-15-10(8)14/h1-2,6,8H,3-4H2,(H,12,13)
InChIKeyDCJQHQVYDLQZRC-UHFFFAOYSA-N
MW203.20 g/mol
LogP0.68
Rot. Bonds2

About 6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile

6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile (PubChem CID 43822801) has the molecular formula C10H9N3O2 and a molecular weight of 203.20 g/mol. Its IUPAC name is 6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile
PubChem CID43822801
Molecular FormulaC10H9N3O2
Molecular Weight203.20 g/mol
Exact Mass203.07
IUPAC Name6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile
SMILESN#Cc1ccc(NC2CCOC2=O)nc1
InChIInChI=1S/C10H9N3O2/c11-5-7-1-2-9(12-6-7)13-8-3-4-15-10(8)14/h1-2,6,8H,3-4H2,(H,12,13)
InChIKeyDCJQHQVYDLQZRC-UHFFFAOYSA-N
XLogP0.68
TPSA75.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-cyanophenyl)-N-[(3S)-2-oxooxolan-3-yl]acetamide
CID 25014867
6-[(4-hydroxycyclohexyl)amino]pyridine-3-carbonitrile
CID 24704980
6-[(2-aminocyclopropyl)amino]pyridine-3-carbonitrile
CID 43598833
6-[[1-(3,4-dichlorophenyl)-2-oxopyrrolidin-3-yl]amino]pyridine-3-carbonitrile
CID 133439006
6-[[1-(oxan-4-ylsulfonyl)piperidin-4-yl]amino]pyridine-3-carbonitrile
CID 133311673
5-cyano-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2-carboxamide
CID 63719488
6-[(5-amino-2,3-dihydro-1H-inden-1-yl)amino]pyridine-3-carbonitrile
CID 79742118
2-[(5-cyano-2-pyridinyl)amino]cyclohexane-1-carboxamide
CID 133365711
6-[[(1S,3R)-3-methylcyclohexyl]amino]pyridine-3-carbonitrile
CID 93287060
1-(5-cyano-2-pyridinyl)-3-cyclohexylurea
CID 55063233
6-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)amino]pyridine-3-carbonitrile
CID 170765192
6-[[4-(3-cyclopropyl-6-oxopyridazin-1-yl)cyclohexyl]amino]pyridine-3-carbonitrile
CID 126935035

Frequently Asked Questions

What is the IUPAC name of 6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile?
The IUPAC name of 6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile (CID 43822801) is 6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile?
The canonical SMILES for 6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile is N#Cc1ccc(NC2CCOC2=O)nc1.
What is the InChIKey of 6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile?
The InChIKey is DCJQHQVYDLQZRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O2/c11-5-7-1-2-9(12-6-7)13-8-3-4-15-10(8)14/h1-2,6,8H,3-4H2,(H,12,13).
What are the key properties of 6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile?
6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile has a molecular weight of 203.20 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-oxooxolan-3-yl)amino]pyridine-3-carbonitrile is sourced from PubChem (CID 43822801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).