(2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone

C19H17N3O2 — CID 110102580

IUPAC(2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone
SMILESO=C(c1cccc2ncccc12)N1CCOC(c2ccncc2)C1
InChIInChI=1S/C19H17N3O2/c23-19(16-3-1-5-17-15(16)4-2-8-21-17)22-11-12-24-18(13-22)14-6-9-20-10-7-14/h1-10,18H,11-13H2
InChIKeyDNKMGFPXAONNKD-UHFFFAOYSA-N
MW319.36 g/mol
LogP2.84
Rot. Bonds2

About (2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone

(2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone (PubChem CID 110102580) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is (2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone.

Molecular Properties

Compound Name(2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone
PubChem CID110102580
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC Name(2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone
SMILESO=C(c1cccc2ncccc12)N1CCOC(c2ccncc2)C1
InChIInChI=1S/C19H17N3O2/c23-19(16-3-1-5-17-15(16)4-2-8-21-17)22-11-12-24-18(13-22)14-6-9-20-10-7-14/h1-10,18H,11-13H2
InChIKeyDNKMGFPXAONNKD-UHFFFAOYSA-N
XLogP2.84
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone?
The IUPAC name of (2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone (CID 110102580) is (2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone.
What is the SMILES notation for (2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone?
The canonical SMILES for (2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone is O=C(c1cccc2ncccc12)N1CCOC(c2ccncc2)C1.
What is the InChIKey of (2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone?
The InChIKey is DNKMGFPXAONNKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2/c23-19(16-3-1-5-17-15(16)4-2-8-21-17)22-11-12-24-18(13-22)14-6-9-20-10-7-14/h1-10,18H,11-13H2.
What are the key properties of (2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone?
(2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone has a molecular weight of 319.36 g/mol, XLogP of 2.84, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-pyridin-4-ylmorpholin-4-yl)-quinolin-5-ylmethanone is sourced from PubChem (CID 110102580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).