5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one

C18H15N3O2 — CID 155586354

IUPAC5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one
SMILESNc1ccc(Oc2ccnc3c2CCC(=O)N3)c2ccccc12
InChIInChI=1S/C18H15N3O2/c19-14-6-7-15(12-4-2-1-3-11(12)14)23-16-9-10-20-18-13(16)5-8-17(22)21-18/h1-4,6-7,9-10H,5,8,19H2,(H,20,21,22)
InChIKeyCQWWMWTUSBZOGY-UHFFFAOYSA-N
MW305.34 g/mol
LogP3.49
Rot. Bonds2

About 5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one

5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one (PubChem CID 155586354) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is 5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one
PubChem CID155586354
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC Name5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one
SMILESNc1ccc(Oc2ccnc3c2CCC(=O)N3)c2ccccc12
InChIInChI=1S/C18H15N3O2/c19-14-6-7-15(12-4-2-1-3-11(12)14)23-16-9-10-20-18-13(16)5-8-17(22)21-18/h1-4,6-7,9-10H,5,8,19H2,(H,20,21,22)
InChIKeyCQWWMWTUSBZOGY-UHFFFAOYSA-N
XLogP3.49
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(8-aminoquinolin-5-yl)oxy-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
CID 58171731
2-amino-8-(4-aminonaphthalen-1-yl)oxy-4H-pyrido[2,3-b]pyrazin-3-one
CID 46901095
5-iodo-3,4-dihydro-1H-1,8-naphthyridin-2-one
CID 135395291
ethane;5-quinolin-5-yloxy-1,4-dihydro-1,8-naphthyridine-2,3-dione
CID 123536143
4-(4-methylpyrimidin-2-yl)oxynaphthalen-1-amine
CID 55225577
2-[2-amino-4-(4-aminonaphthalen-1-yl)oxy-3-pyridinyl]propanehydrazide
CID 89258278
4-(1-ethylimidazo[4,5-b]pyridin-7-yl)oxynaphthalen-1-amine
CID 123654499
4-[(3-chloro-2-pyridinyl)oxy]naphthalen-1-amine
CID 55228286
5-ethyliodanuidyl-3,4-dihydro-1H-1,8-naphthyridin-2-one
CID 163523317
ethyl (1R,2R,3S)-2-[2-hydroxy-5-[(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-4-yl)oxy]phenyl]-3-methylcyclopropane-1-carboxylate
CID 149053034
8-(4-aminonaphthalen-1-yl)oxy-2-(1,1-difluoroprop-2-enyl)-4H-pyrido[2,3-b]pyrazin-3-one
CID 162556816
ethyl (1R,1aS,6bS)-5-[(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-4-yl)oxy]-1a,6b-dihydro-1H-cyclopropa[b][1]benzofuran-1-carboxylate
CID 140919947

Frequently Asked Questions

What is the IUPAC name of 5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one?
The IUPAC name of 5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one (CID 155586354) is 5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one.
What is the SMILES notation for 5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one?
The canonical SMILES for 5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one is Nc1ccc(Oc2ccnc3c2CCC(=O)N3)c2ccccc12.
What is the InChIKey of 5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one?
The InChIKey is CQWWMWTUSBZOGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c19-14-6-7-15(12-4-2-1-3-11(12)14)23-16-9-10-20-18-13(16)5-8-17(22)21-18/h1-4,6-7,9-10H,5,8,19H2,(H,20,21,22).
What are the key properties of 5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one?
5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one has a molecular weight of 305.34 g/mol, XLogP of 3.49, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-aminonaphthalen-1-yl)oxy-3,4-dihydro-1H-1,8-naphthyridin-2-one is sourced from PubChem (CID 155586354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).