4-(6,7-dimethoxycinnolin-4-yl)morpholine

C14H17N3O3 — CID 58674716

IUPAC4-(6,7-dimethoxycinnolin-4-yl)morpholine
SMILESCOc1cc2nncc(N3CCOCC3)c2cc1OC
InChIInChI=1S/C14H17N3O3/c1-18-13-7-10-11(8-14(13)19-2)16-15-9-12(10)17-3-5-20-6-4-17/h7-9H,3-6H2,1-2H3
InChIKeyPFPLJYUNHMUIBK-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.48
Rot. Bonds3

About 4-(6,7-dimethoxycinnolin-4-yl)morpholine

4-(6,7-dimethoxycinnolin-4-yl)morpholine (PubChem CID 58674716) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is 4-(6,7-dimethoxycinnolin-4-yl)morpholine.

Molecular Properties

Compound Name4-(6,7-dimethoxycinnolin-4-yl)morpholine
PubChem CID58674716
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name4-(6,7-dimethoxycinnolin-4-yl)morpholine
SMILESCOc1cc2nncc(N3CCOCC3)c2cc1OC
InChIInChI=1S/C14H17N3O3/c1-18-13-7-10-11(8-14(13)19-2)16-15-9-12(10)17-3-5-20-6-4-17/h7-9H,3-6H2,1-2H3
InChIKeyPFPLJYUNHMUIBK-UHFFFAOYSA-N
XLogP1.48
TPSA56.71 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(6,7-dimethoxycinnolin-4-yl)morpholine?
The IUPAC name of 4-(6,7-dimethoxycinnolin-4-yl)morpholine (CID 58674716) is 4-(6,7-dimethoxycinnolin-4-yl)morpholine.
What is the SMILES notation for 4-(6,7-dimethoxycinnolin-4-yl)morpholine?
The canonical SMILES for 4-(6,7-dimethoxycinnolin-4-yl)morpholine is COc1cc2nncc(N3CCOCC3)c2cc1OC.
What is the InChIKey of 4-(6,7-dimethoxycinnolin-4-yl)morpholine?
The InChIKey is PFPLJYUNHMUIBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-18-13-7-10-11(8-14(13)19-2)16-15-9-12(10)17-3-5-20-6-4-17/h7-9H,3-6H2,1-2H3.
What are the key properties of 4-(6,7-dimethoxycinnolin-4-yl)morpholine?
4-(6,7-dimethoxycinnolin-4-yl)morpholine has a molecular weight of 275.31 g/mol, XLogP of 1.48, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6,7-dimethoxycinnolin-4-yl)morpholine is sourced from PubChem (CID 58674716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).