4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile

C9H12N6O — CID 80929416

IUPAC4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile
SMILESN#CC1CN(c2ccnc(NN)n2)CCO1
InChIInChI=1S/C9H12N6O/c10-5-7-6-15(3-4-16-7)8-1-2-12-9(13-8)14-11/h1-2,7H,3-4,6,11H2,(H,12,13,14)
InChIKeyYOIATALSALFLTB-UHFFFAOYSA-N
MW220.24 g/mol
LogP-0.51
Rot. Bonds2

About 4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile

4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile (PubChem CID 80929416) has the molecular formula C9H12N6O and a molecular weight of 220.24 g/mol. Its IUPAC name is 4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile.

Molecular Properties

Compound Name4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile
PubChem CID80929416
Molecular FormulaC9H12N6O
Molecular Weight220.24 g/mol
Exact Mass220.11
IUPAC Name4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile
SMILESN#CC1CN(c2ccnc(NN)n2)CCO1
InChIInChI=1S/C9H12N6O/c10-5-7-6-15(3-4-16-7)8-1-2-12-9(13-8)14-11/h1-2,7H,3-4,6,11H2,(H,12,13,14)
InChIKeyYOIATALSALFLTB-UHFFFAOYSA-N
XLogP-0.51
TPSA100.09 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.24
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[4-(2-methyl-1,4-oxazepan-4-yl)pyrimidin-2-yl]hydrazine
CID 80918713
4-pyridin-2-ylmorpholine-2-carbonitrile
CID 78946454
6-(2-cyanomorpholin-4-yl)pyridine-2-carboxylic acid
CID 79681061
[4-(azocan-1-yl)pyrimidin-2-yl]hydrazine
CID 80932713
4-[2-amino-6-(methylamino)pyrimidin-4-yl]morpholine-2-carbonitrile
CID 80850367
4-(6-ethoxy-2-pyridinyl)morpholine-2-carbonitrile
CID 79675246
4-phenylmorpholine-2-carbonitrile
CID 67651414
[4-(3,4-dimethoxypyrrolidin-1-yl)pyrimidin-2-yl]hydrazine
CID 103542149
[4-(4-cyclopropylpiperazin-1-yl)pyrimidin-2-yl]hydrazine
CID 80895559
4-(6-cyano-3-pyridinyl)morpholine-2-carbonitrile
CID 79838851
4-[6-(methylamino)pyrazin-2-yl]morpholine-2-carbonitrile
CID 80849516
4-(2-aminophenyl)morpholine-2-carbonitrile
CID 79674348

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile?
The IUPAC name of 4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile (CID 80929416) is 4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile.
What is the SMILES notation for 4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile?
The canonical SMILES for 4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile is N#CC1CN(c2ccnc(NN)n2)CCO1.
What is the InChIKey of 4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile?
The InChIKey is YOIATALSALFLTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N6O/c10-5-7-6-15(3-4-16-7)8-1-2-12-9(13-8)14-11/h1-2,7H,3-4,6,11H2,(H,12,13,14).
What are the key properties of 4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile?
4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile has a molecular weight of 220.24 g/mol, XLogP of -0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydrazinylpyrimidin-4-yl)morpholine-2-carbonitrile is sourced from PubChem (CID 80929416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).