6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile

C14H15N5O — CID 154756720

IUPAC6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile
SMILESCn1nccc1[C@H]1OCC[C@@H]1Nc1ccc(C#N)cn1
InChIInChI=1S/C14H15N5O/c1-19-12(4-6-17-19)14-11(5-7-20-14)18-13-3-2-10(8-15)9-16-13/h2-4,6,9,11,14H,5,7H2,1H3,(H,16,18)/t11-,14-/m0/s1
InChIKeyIXIGTGWWVOHHQP-FZMZJTMJSA-N
MW269.31 g/mol
LogP1.63
Rot. Bonds3

About 6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile

6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile (PubChem CID 154756720) has the molecular formula C14H15N5O and a molecular weight of 269.31 g/mol. Its IUPAC name is 6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile
PubChem CID154756720
Molecular FormulaC14H15N5O
Molecular Weight269.31 g/mol
Exact Mass269.13
IUPAC Name6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile
SMILESCn1nccc1[C@H]1OCC[C@@H]1Nc1ccc(C#N)cn1
InChIInChI=1S/C14H15N5O/c1-19-12(4-6-17-19)14-11(5-7-20-14)18-13-3-2-10(8-15)9-16-13/h2-4,6,9,11,14H,5,7H2,1H3,(H,16,18)/t11-,14-/m0/s1
InChIKeyIXIGTGWWVOHHQP-FZMZJTMJSA-N
XLogP1.63
TPSA75.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-cyano-2-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]benzenesulfonamide
CID 128975404
(2S,3S)-N-(5-cyano-2-pyridinyl)-2-(1,5-dimethylpyrazol-4-yl)oxolane-3-carboxamide
CID 129003975
6-[(2-aminocyclopropyl)amino]pyridine-3-carbonitrile
CID 43598833
4-(cyclopropylmethoxy)-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]benzamide
CID 128986254
N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]-1H-benzimidazol-2-amine
CID 154744650
6-[1-(4-methylmorpholin-2-yl)ethylamino]pyridine-3-carbonitrile
CID 133386452
6-[(4-hydroxycyclohexyl)amino]pyridine-3-carbonitrile
CID 24704980
2-[(5-cyano-2-pyridinyl)amino]cyclohexane-1-carboxamide
CID 133365711
N-(5-cyano-2-pyridinyl)-2-ethyloxolane-3-carboxamide
CID 114105635
6-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyridine-2-carboxamide
CID 128986477
5-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 128986488
2-(4-fluorophenoxy)-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]acetamide
CID 128969807

Frequently Asked Questions

What is the IUPAC name of 6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile?
The IUPAC name of 6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile (CID 154756720) is 6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile?
The canonical SMILES for 6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile is Cn1nccc1[C@H]1OCC[C@@H]1Nc1ccc(C#N)cn1.
What is the InChIKey of 6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile?
The InChIKey is IXIGTGWWVOHHQP-FZMZJTMJSA-N. The full InChI is InChI=1S/C14H15N5O/c1-19-12(4-6-17-19)14-11(5-7-20-14)18-13-3-2-10(8-15)9-16-13/h2-4,6,9,11,14H,5,7H2,1H3,(H,16,18)/t11-,14-/m0/s1.
What are the key properties of 6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile?
6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile has a molecular weight of 269.31 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile is sourced from PubChem (CID 154756720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).