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

C15H13N3O2 — CID 78945922

IUPAC4-(quinoline-2-carbonyl)morpholine-2-carbonitrile
SMILESN#CC1CN(C(=O)c2ccc3ccccc3n2)CCO1
InChIInChI=1S/C15H13N3O2/c16-9-12-10-18(7-8-20-12)15(19)14-6-5-11-3-1-2-4-13(11)17-14/h1-6,12H,7-8,10H2
InChIKeyQPSDNEUIVQPHFU-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.60
Rot. Bonds1

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

4-(quinoline-2-carbonyl)morpholine-2-carbonitrile (PubChem CID 78945922) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 4-(quinoline-2-carbonyl)morpholine-2-carbonitrile.

Molecular Properties

Compound Name4-(quinoline-2-carbonyl)morpholine-2-carbonitrile
PubChem CID78945922
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name4-(quinoline-2-carbonyl)morpholine-2-carbonitrile
SMILESN#CC1CN(C(=O)c2ccc3ccccc3n2)CCO1
InChIInChI=1S/C15H13N3O2/c16-9-12-10-18(7-8-20-12)15(19)14-6-5-11-3-1-2-4-13(11)17-14/h1-6,12H,7-8,10H2
InChIKeyQPSDNEUIVQPHFU-UHFFFAOYSA-N
XLogP1.60
TPSA66.22 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(6-aminopyridine-2-carbonyl)morpholine-2-carbonitrile
CID 79675623
4-(6-chloropyridazine-3-carbonyl)morpholine-2-carbonitrile
CID 79674643
4-(2-chloroquinoline-4-carbonyl)morpholine-2-carbonitrile
CID 78945462
4-(3-aminonaphthalene-2-carbonyl)morpholine-2-carbonitrile
CID 79670203
4-[5-(methylamino)pyridine-2-carbonyl]morpholine-2-carbonitrile
CID 104641747
4-[5-(trifluoromethyl)pyridine-2-carbonyl]morpholine-2-carbonitrile
CID 115616275
4-(quinolin-2-ylmethyl)morpholine-2-carbonitrile
CID 78995631
4-(2H-triazole-4-carbonyl)morpholine-2-carbonitrile
CID 78945733
[(3R,5R)-3,5-dimethylpiperidin-1-yl]-quinolin-2-ylmethanone
CID 40744893
[2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]-quinolin-2-ylmethanone
CID 128969841
4-(pyridine-3-carbonyl)morpholine-2-carbonitrile
CID 78945686
azepan-1-yl(quinolin-2-yl)methanone
CID 7779308

Frequently Asked Questions

What is the IUPAC name of 4-(quinoline-2-carbonyl)morpholine-2-carbonitrile?
The IUPAC name of 4-(quinoline-2-carbonyl)morpholine-2-carbonitrile (CID 78945922) is 4-(quinoline-2-carbonyl)morpholine-2-carbonitrile.
What is the SMILES notation for 4-(quinoline-2-carbonyl)morpholine-2-carbonitrile?
The canonical SMILES for 4-(quinoline-2-carbonyl)morpholine-2-carbonitrile is N#CC1CN(C(=O)c2ccc3ccccc3n2)CCO1.
What is the InChIKey of 4-(quinoline-2-carbonyl)morpholine-2-carbonitrile?
The InChIKey is QPSDNEUIVQPHFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c16-9-12-10-18(7-8-20-12)15(19)14-6-5-11-3-1-2-4-13(11)17-14/h1-6,12H,7-8,10H2.
What are the key properties of 4-(quinoline-2-carbonyl)morpholine-2-carbonitrile?
4-(quinoline-2-carbonyl)morpholine-2-carbonitrile has a molecular weight of 267.29 g/mol, XLogP of 1.60, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(quinoline-2-carbonyl)morpholine-2-carbonitrile is sourced from PubChem (CID 78945922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).