4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile

C11H12N4O2 — CID 79676652

IUPAC4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile
SMILESN#CC1CN(C(=O)c2ccnc(N)c2)CCO1
InChIInChI=1S/C11H12N4O2/c12-6-9-7-15(3-4-17-9)11(16)8-1-2-14-10(13)5-8/h1-2,5,9H,3-4,7H2,(H2,13,14)
InChIKeyMGWDZTAJGIVYRB-UHFFFAOYSA-N
MW232.24 g/mol
LogP0.03
Rot. Bonds1

About 4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile

4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile (PubChem CID 79676652) has the molecular formula C11H12N4O2 and a molecular weight of 232.24 g/mol. Its IUPAC name is 4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile.

Molecular Properties

Compound Name4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile
PubChem CID79676652
Molecular FormulaC11H12N4O2
Molecular Weight232.24 g/mol
Exact Mass232.10
IUPAC Name4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile
SMILESN#CC1CN(C(=O)c2ccnc(N)c2)CCO1
InChIInChI=1S/C11H12N4O2/c12-6-9-7-15(3-4-17-9)11(16)8-1-2-14-10(13)5-8/h1-2,5,9H,3-4,7H2,(H2,13,14)
InChIKeyMGWDZTAJGIVYRB-UHFFFAOYSA-N
XLogP0.03
TPSA92.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(quinoxaline-6-carbonyl)morpholine-2-carbonitrile
CID 78945959
4-(3,4-dichlorobenzoyl)morpholine-2-carbonitrile
CID 78945567
4-(3,4-difluorobenzoyl)morpholine-2-carbonitrile
CID 78945954
4-(pyridine-3-carbonyl)morpholine-2-carbonitrile
CID 78945686
4-(3H-benzimidazole-5-carbonyl)morpholine-2-carbonitrile
CID 78946024
4-(6-aminopyridine-2-carbonyl)morpholine-2-carbonitrile
CID 79675623
4-(3,5-dimethylbenzoyl)morpholine-2-carbonitrile
CID 78945545
4-(3-methylsulfonylbenzoyl)morpholine-2-carbonitrile
CID 78945893
4-(3-chloro-4-fluorobenzoyl)morpholine-2-carbonitrile
CID 81435497
4-(3,5-dimethoxybenzoyl)morpholine-2-carbonitrile
CID 78945956
4-(3-aminonaphthalene-2-carbonyl)morpholine-2-carbonitrile
CID 79670203
4-(3-methylpyridine-2-carbonyl)morpholine-2-carbonitrile
CID 79674607

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile?
The IUPAC name of 4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile (CID 79676652) is 4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile.
What is the SMILES notation for 4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile?
The canonical SMILES for 4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile is N#CC1CN(C(=O)c2ccnc(N)c2)CCO1.
What is the InChIKey of 4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile?
The InChIKey is MGWDZTAJGIVYRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2/c12-6-9-7-15(3-4-17-9)11(16)8-1-2-14-10(13)5-8/h1-2,5,9H,3-4,7H2,(H2,13,14).
What are the key properties of 4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile?
4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile has a molecular weight of 232.24 g/mol, XLogP of 0.03, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminopyridine-4-carbonyl)morpholine-2-carbonitrile is sourced from PubChem (CID 79676652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).