1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one

C23H26N4O2 — CID 46701508

IUPAC1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one
SMILESO=c1ccc2cnc(Nc3ccc(N4CCOCC4)cc3)cc2n1C1CCCC1
InChIInChI=1S/C23H26N4O2/c28-23-10-5-17-16-24-22(15-21(17)27(23)20-3-1-2-4-20)25-18-6-8-19(9-7-18)26-11-13-29-14-12-26/h5-10,15-16,20H,1-4,11-14H2,(H,24,25)
InChIKeyVARMIONXVVBZMY-UHFFFAOYSA-N
MW390.49 g/mol
LogP4.09
Rot. Bonds4

About 1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one

1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one (PubChem CID 46701508) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is 1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one.

Molecular Properties

Compound Name1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one
PubChem CID46701508
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC Name1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one
SMILESO=c1ccc2cnc(Nc3ccc(N4CCOCC4)cc3)cc2n1C1CCCC1
InChIInChI=1S/C23H26N4O2/c28-23-10-5-17-16-24-22(15-21(17)27(23)20-3-1-2-4-20)25-18-6-8-19(9-7-18)26-11-13-29-14-12-26/h5-10,15-16,20H,1-4,11-14H2,(H,24,25)
InChIKeyVARMIONXVVBZMY-UHFFFAOYSA-N
XLogP4.09
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

1-cyclobutyl-7-[4-(4-methylpiperazin-1-yl)anilino]-1,6-naphthyridin-2-one
CID 46701507
1-cyclopentyl-7-(4-pyrazol-1-ylanilino)-1,6-naphthyridin-2-one
CID 22124690
8-cyclopentyl-2-(4-morpholin-4-ylanilino)pyrido[2,3-d]pyrimidin-7-one
CID 5330331
1-cyclopentyl-3-fluoro-7-[4-(4-hydroxypiperidin-1-yl)anilino]-1,6-naphthyridin-2-one
CID 22124688
1-methyl-7-(4-piperidin-1-ylanilino)-1,6-naphthyridin-2-one
CID 22124727
1-cyclohexyl-3-fluoro-7-[4-[4-(3-morpholin-4-ylpropyl)piperidin-1-yl]anilino]-1,6-naphthyridin-2-one
CID 22124588
1-cyclopentyl-2-oxo-7-(4-piperazin-1-ylanilino)-1,6-naphthyridine-3-carbonitrile
CID 155458659
1-propan-2-yl-7-(4-pyrrolidin-1-ylanilino)-1,6-naphthyridin-2-one
CID 22124675
7-[4-(4-hydroxypiperidin-1-yl)anilino]-1-propan-2-yl-1,6-naphthyridin-2-one
CID 22124851
1-(2-bicyclo[2.2.1]heptanyl)-7-[4-[4-(3-hydroxypropyl)piperidin-1-yl]anilino]-1,6-naphthyridin-2-one
CID 22124548
1-ethyl-7-[4-[3-(hydroxymethyl)piperidin-1-yl]anilino]-1,6-naphthyridin-2-one
CID 22124798
1-[4-[(8-cyclohexyl-7-oxopyrido[2,3-d]pyrimidin-2-yl)amino]phenyl]piperidine-4-carboxylic acid
CID 18375092

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one?
The IUPAC name of 1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one (CID 46701508) is 1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one.
What is the SMILES notation for 1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one?
The canonical SMILES for 1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one is O=c1ccc2cnc(Nc3ccc(N4CCOCC4)cc3)cc2n1C1CCCC1.
What is the InChIKey of 1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one?
The InChIKey is VARMIONXVVBZMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c28-23-10-5-17-16-24-22(15-21(17)27(23)20-3-1-2-4-20)25-18-6-8-19(9-7-18)26-11-13-29-14-12-26/h5-10,15-16,20H,1-4,11-14H2,(H,24,25).
What are the key properties of 1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one?
1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one has a molecular weight of 390.49 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-7-(4-morpholin-4-ylanilino)-1,6-naphthyridin-2-one is sourced from PubChem (CID 46701508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).