[3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone

C17H20N4O2 — CID 154780983

IUPAC[3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone
SMILESO=C(c1nccc2cccnc12)N1CC(CN2CCOCC2)C1
InChIInChI=1S/C17H20N4O2/c22-17(16-15-14(3-5-19-16)2-1-4-18-15)21-11-13(12-21)10-20-6-8-23-9-7-20/h1-5,13H,6-12H2
InChIKeyGDNLUQJPMOLOOQ-UHFFFAOYSA-N
MW312.37 g/mol
LogP1.03
Rot. Bonds3

About [3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone

[3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone (PubChem CID 154780983) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is [3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone.

Molecular Properties

Compound Name[3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone
PubChem CID154780983
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC Name[3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone
SMILESO=C(c1nccc2cccnc12)N1CC(CN2CCOCC2)C1
InChIInChI=1S/C17H20N4O2/c22-17(16-15-14(3-5-19-16)2-1-4-18-15)21-11-13(12-21)10-20-6-8-23-9-7-20/h1-5,13H,6-12H2
InChIKeyGDNLUQJPMOLOOQ-UHFFFAOYSA-N
XLogP1.03
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[(4aS,7aR)-4-methyl-2,3,4a,5,7,7a-hexahydropyrrolo[3,4-b][1,4]oxazin-6-yl]-(1,7-naphthyridin-8-yl)methanone
CID 136586518
[(2R)-2-methylpyrrolidin-1-yl]-(1,7-naphthyridin-8-yl)methanone
CID 123840614
[4-(4-methyl-3-pyridinyl)piperazin-1-yl]-(1,7-naphthyridin-8-yl)methanone
CID 138023297
(4-chloro-1,5-dimethylpyrazol-3-yl)-[3-(morpholin-4-ylmethyl)azetidin-1-yl]methanone
CID 138035622
(3,4-dihydroxypyrrolidin-1-yl)-isoquinolin-1-ylmethanone
CID 106671738
[4-(cyclobutylmethyl)piperazin-1-yl]-isoquinolin-1-ylmethanone;2,2,2-trifluoroacetic acid
CID 154891501
1-[3-(morpholin-4-ylmethyl)azetidin-1-yl]ethanone
CID 130138001
N-(2-morpholin-4-ylethyl)quinoline-8-carboxamide
CID 30370396
3-[[16-[(2-carboxy-3-pyridinyl)methyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]methyl]pyridine-2-carboxylic acid
CID 174155383
8-(isoquinoline-1-carbonyl)-1,4,8-oxadiazecan-5-one
CID 110200979
13-(1,10-phenanthrolin-2-ylmethyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane
CID 100957507
(3-amino-2-pyridinyl)-(1,4-oxazepan-4-yl)methanone
CID 104742252

Frequently Asked Questions

What is the IUPAC name of [3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone?
The IUPAC name of [3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone (CID 154780983) is [3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone.
What is the SMILES notation for [3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone?
The canonical SMILES for [3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone is O=C(c1nccc2cccnc12)N1CC(CN2CCOCC2)C1.
What is the InChIKey of [3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone?
The InChIKey is GDNLUQJPMOLOOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2/c22-17(16-15-14(3-5-19-16)2-1-4-18-15)21-11-13(12-21)10-20-6-8-23-9-7-20/h1-5,13H,6-12H2.
What are the key properties of [3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone?
[3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone has a molecular weight of 312.37 g/mol, XLogP of 1.03, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(morpholin-4-ylmethyl)azetidin-1-yl]-(1,7-naphthyridin-8-yl)methanone is sourced from PubChem (CID 154780983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).