morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone

C17H19N3O2 — CID 58440618

IUPACmorpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone
SMILESO=C(c1c2c(nc3ccccc13)CCNC2)N1CCOCC1
InChIInChI=1S/C17H19N3O2/c21-17(20-7-9-22-10-8-20)16-12-3-1-2-4-14(12)19-15-5-6-18-11-13(15)16/h1-4,18H,5-11H2
InChIKeyPXVAKOJZODWYDO-UHFFFAOYSA-N
MW297.36 g/mol
LogP1.35
Rot. Bonds1

About morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone

morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone (PubChem CID 58440618) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone
PubChem CID58440618
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Namemorpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone
SMILESO=C(c1c2c(nc3ccccc13)CCNC2)N1CCOCC1
InChIInChI=1S/C17H19N3O2/c21-17(20-7-9-22-10-8-20)16-12-3-1-2-4-14(12)19-15-5-6-18-11-13(15)16/h1-4,18H,5-11H2
InChIKeyPXVAKOJZODWYDO-UHFFFAOYSA-N
XLogP1.35
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

piperidin-1-yl(1,2,3,4-tetrahydroacridin-9-yl)methanone
CID 23499
2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone
CID 55735652
4-[[2-[10-(morpholine-4-carbonyl)-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-2-yl]-2-oxoethyl]amino]benzonitrile
CID 46212983
(3-methyl-2-phenylquinolin-4-yl)-morpholin-4-ylmethanone
CID 868745
2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-(2-methylmorpholin-4-yl)methanone
CID 42929324
2-[4-(2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbonyl)piperazin-1-yl]acetic acid
CID 21203408
(1-morpholin-4-yl-1-oxopropan-2-yl) 2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylate
CID 16533571
2-(11-methyl-1,2,4,5-tetrahydroazepino[4,5-b]quinolin-3-yl)-1-morpholin-4-ylethanone
CID 158645776
N-(5-chloro-1-benzofuran-7-yl)-2-[10-(morpholine-4-carbonyl)-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-2-yl]acetamide
CID 46213295
morpholin-4-yl-(2-morpholin-2-ylquinolin-4-yl)methanone
CID 110089333
N-(4-morpholin-4-ylphenyl)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 8961124
1,2,3,4-tetrahydroacridine-9-carboxylic acid;hydrate
CID 16667447

Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone?
The IUPAC name of morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone (CID 58440618) is morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone.
What is the SMILES notation for morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone?
The canonical SMILES for morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone is O=C(c1c2c(nc3ccccc13)CCNC2)N1CCOCC1.
What is the InChIKey of morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone?
The InChIKey is PXVAKOJZODWYDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c21-17(20-7-9-22-10-8-20)16-12-3-1-2-4-14(12)19-15-5-6-18-11-13(15)16/h1-4,18H,5-11H2.
What are the key properties of morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone?
morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone has a molecular weight of 297.36 g/mol, XLogP of 1.35, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone is sourced from PubChem (CID 58440618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).