3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine

C36H44N6O2 — CID 10188738

IUPAC3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine
SMILESc1cc2nc3ccc4cc5cc(CNCCCN6CCOCC6)ccc5nc4c3cc2cc1CNCCCN1CCOCC1
InChIInChI=1S/C36H44N6O2/c1(11-41-13-17-43-18-14-41)9-37-25-27-4-7-34-30(21-27)23-29-5-8-35-32(36(29)40-34)24-31-22-28(3-6-33(31)39-35)26-38-10-2-12-42-15-19-44-20-16-42/h3-8,21-24,37-38H,1-2,9-20,25-26H2
InChIKeyAGHWPGPRTLBUMR-UHFFFAOYSA-N
MW592.79 g/mol
LogP4.71
Rot. Bonds12

About 3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine

3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine (PubChem CID 10188738) has the molecular formula C36H44N6O2 and a molecular weight of 592.79 g/mol. Its IUPAC name is 3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine.

Molecular Properties

Compound Name3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine
PubChem CID10188738
Molecular FormulaC36H44N6O2
Molecular Weight592.79 g/mol
Exact Mass592.35
IUPAC Name3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine
SMILESc1cc2nc3ccc4cc5cc(CNCCCN6CCOCC6)ccc5nc4c3cc2cc1CNCCCN1CCOCC1
InChIInChI=1S/C36H44N6O2/c1(11-41-13-17-43-18-14-41)9-37-25-27-4-7-34-30(21-27)23-29-5-8-35-32(36(29)40-34)24-31-22-28(3-6-33(31)39-35)26-38-10-2-12-42-15-19-44-20-16-42/h3-8,21-24,37-38H,1-2,9-20,25-26H2
InChIKeyAGHWPGPRTLBUMR-UHFFFAOYSA-N
XLogP4.71
TPSA74.78 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms44
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500592.79
LogP ≤ 54.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine 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

Bis(7)-tacrine
CID 9549196
Bis(3)-cognitin
CID 12069888
Bis-9-aminoacridine
CID 153631
Methylbis[3-(1,2,3,4-tetrahydroacridin-9-ylamino)propyl]amine
CID 10481357
N-[8-(1,2,3,4-tetrahydroacridin-9-ylamino)octyl]-1,2,3,4-tetrahydroacridin-9-amine
CID 10625415
Ethylbis[3-(1,2,3,4-tetrahydroacridin-9-ylamino)propyl]amine
CID 11191634
N,N'-Di-1,2,3,4-Tetrahydroacridin-9-Ylpentane-1,5-Diamine
CID 9549197
N,N'-bis(1,2,3,4-tetrahydroacridin-9-yl)butane-1,4-diamine
CID 10253254
N1,N6-Di-9-acridinyl-1,6-hexanediamine
CID 42875
N1,N4-Di-9-acridinyl-1,4-piperazinedipropanamine
CID 435901
N,N'-di[(9Z)-1,3,4,10-tetrahydroacridin-9(2H)-ylidene]hexane-1,6-diamine
CID 1593398
N-[9-(1,2,3,4-tetrahydroacridin-9-ylamino)nonyl]-1,2,3,4-tetrahydroacridin-9-amine
CID 11800131

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine?
The IUPAC name of 3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine (CID 10188738) is 3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine.
What is the SMILES notation for 3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine?
The canonical SMILES for 3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine is c1cc2nc3ccc4cc5cc(CNCCCN6CCOCC6)ccc5nc4c3cc2cc1CNCCCN1CCOCC1.
What is the InChIKey of 3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine?
The InChIKey is AGHWPGPRTLBUMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H44N6O2/c1(11-41-13-17-43-18-14-41)9-37-25-27-4-7-34-30(21-27)23-29-5-8-35-32(36(29)40-34)24-31-22-28(3-6-33(31)39-35)26-38-10-2-12-42-15-19-44-20-16-42/h3-8,21-24,37-38H,1-2,9-20,25-26H2.
What are the key properties of 3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine?
3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine has a molecular weight of 592.79 g/mol, XLogP of 4.71, 12 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yl-N-[[10-[(3-morpholin-4-ylpropylamino)methyl]quinolino[2,3-a]acridin-2-yl]methyl]propan-1-amine is sourced from PubChem (CID 10188738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).