4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid

C22H22N2O6 — CID 2998399

IUPAC4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid
SMILESCOc1ccc2c(-c3ccccc3)cc(N3CCOCC3)nc2c1.O=C(O)C(=O)O
InChIInChI=1S/C20H20N2O2.C2H2O4/c1-23-16-7-8-17-18(15-5-3-2-4-6-15)14-20(21-19(17)13-16)22-9-11-24-12-10-22;3-1(4)2(5)6/h2-8,13-14H,9-12H2,1H3;(H,3,4)(H,5,6)
InChIKeyDYMRRLYWVKGWGO-UHFFFAOYSA-N
MW410.43 g/mol
LogP2.90
Rot. Bonds3

About 4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid

4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid (PubChem CID 2998399) has the molecular formula C22H22N2O6 and a molecular weight of 410.43 g/mol. Its IUPAC name is 4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid.

Molecular Properties

Compound Name4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid
PubChem CID2998399
Molecular FormulaC22H22N2O6
Molecular Weight410.43 g/mol
Exact Mass410.15
IUPAC Name4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid
SMILESCOc1ccc2c(-c3ccccc3)cc(N3CCOCC3)nc2c1.O=C(O)C(=O)O
InChIInChI=1S/C20H20N2O2.C2H2O4/c1-23-16-7-8-17-18(15-5-3-2-4-6-15)14-20(21-19(17)13-16)22-9-11-24-12-10-22;3-1(4)2(5)6/h2-8,13-14H,9-12H2,1H3;(H,3,4)(H,5,6)
InChIKeyDYMRRLYWVKGWGO-UHFFFAOYSA-N
XLogP2.90
TPSA109.19 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.43
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid 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

(2R)-2-(7-methoxy-4-phenylquinolin-2-yl)sulfanyl-N-(4-morpholin-4-ylphenyl)propanamide
CID 25349930
4-(6-methyl-4-phenylquinolin-2-yl)morpholine
CID 39860405
2-(7-methoxy-4-phenylquinolin-2-yl)sulfanyl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
CID 24677995
[1-(7-methoxy-4-methylquinolin-2-yl)azetidin-3-yl]-morpholin-4-ylmethanone
CID 163354868
2-(7-methoxy-4-phenylquinolin-2-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone
CID 17402158
methyl 4-(6-morpholin-4-yl-2-phenylpyrimidin-4-yl)oxybenzoate
CID 23827389
1-[(2S)-2-(7-methoxy-4-phenylquinolin-2-yl)sulfanylpropanoyl]imidazolidin-2-one
CID 40679039
N-(2,4-dimethoxyphenyl)-6-morpholin-4-yl-2-phenylpyrimidin-4-amine
CID 112880580
(2R)-2-(7-methoxy-4-phenylquinolin-2-yl)sulfanyl-2-phenylacetamide
CID 42488590
[2-(1,4-oxazepan-4-yl)quinolin-4-yl]methanol
CID 62973118
(2R)-2-(7-methoxy-4-phenylquinolin-2-yl)sulfanyl-N-(methylcarbamoyl)propanamide
CID 2548817
4-(6,7-dimethoxy-4-phenylnaphthalen-2-yl)morpholine
CID 3376794

Frequently Asked Questions

What is the IUPAC name of 4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid?
The IUPAC name of 4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid (CID 2998399) is 4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid.
What is the SMILES notation for 4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid?
The canonical SMILES for 4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid is COc1ccc2c(-c3ccccc3)cc(N3CCOCC3)nc2c1.O=C(O)C(=O)O.
What is the InChIKey of 4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid?
The InChIKey is DYMRRLYWVKGWGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2.C2H2O4/c1-23-16-7-8-17-18(15-5-3-2-4-6-15)14-20(21-19(17)13-16)22-9-11-24-12-10-22;3-1(4)2(5)6/h2-8,13-14H,9-12H2,1H3;(H,3,4)(H,5,6).
What are the key properties of 4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid?
4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid has a molecular weight of 410.43 g/mol, XLogP of 2.90, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-methoxy-4-phenylquinolin-2-yl)morpholine;oxalic acid is sourced from PubChem (CID 2998399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).