3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine

C21H24N2O — CID 10215127

IUPAC3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine
SMILESCCOc1ccc2c(c1)Nc1ccccc1C2=C1CCN(C)CC1
InChIInChI=1S/C21H24N2O/c1-3-24-16-8-9-18-20(14-16)22-19-7-5-4-6-17(19)21(18)15-10-12-23(2)13-11-15/h4-9,14,22H,3,10-13H2,1-2H3
InChIKeyOFQLDZMPIOGDNJ-UHFFFAOYSA-N
MW320.44 g/mol
LogP4.67
Rot. Bonds2

About 3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine

3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine (PubChem CID 10215127) has the molecular formula C21H24N2O and a molecular weight of 320.44 g/mol. Its IUPAC name is 3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine.

Molecular Properties

Compound Name3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine
PubChem CID10215127
Molecular FormulaC21H24N2O
Molecular Weight320.44 g/mol
Exact Mass320.19
IUPAC Name3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine
SMILESCCOc1ccc2c(c1)Nc1ccccc1C2=C1CCN(C)CC1
InChIInChI=1S/C21H24N2O/c1-3-24-16-8-9-18-20(14-16)22-19-7-5-4-6-17(19)21(18)15-10-12-23(2)13-11-15/h4-9,14,22H,3,10-13H2,1-2H3
InChIKeyOFQLDZMPIOGDNJ-UHFFFAOYSA-N
XLogP4.67
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-[4-(4-phenylpiperazin-1-yl)butoxy]-3,4-dihydro-1H-quinolin-2-one
CID 12899503
1-(3-(Benzyloxy)-2-methylphenyl)piperazine
CID 25263303
1-(2-(Phenoxymethyl)phenyl)piperazine
CID 45483466
Tetra-hydro-isoquinoline derivative 3
CID 137653313
7-[4-[4-(2-ethoxyphenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one
CID 10502413
7-(4-(4-(2-methoxyphenyl)piperazin-1-yl)butoxy)-3,4-dihydroquinolin-2(1H)-one
CID 10692886
1-Methyl-4-[4-[4-(3-piperidin-1-ylpropoxy)phenyl]phenyl]piperazine
CID 57672016
8-Methoxy-1,2,3,5,6,7-hexahydropyrido[3,2,1-ij]quinoline
CID 2829840
1-{3-[(3-Fluorophenyl)methoxy]-2-methylphenyl}piperazine
CID 25263304
3-[2-Methyl-3-(piperazin-1-yl)phenoxymethyl]benzonitrile
CID 25263306
1-{3-[(2-Fluorophenyl)methoxy]-2-methylphenyl}piperazine
CID 25263307
1-{3-[(3,4-Difluorophenyl)methoxy]-2-methylphenyl}piperazine
CID 25263308

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine?
The IUPAC name of 3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine (CID 10215127) is 3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine.
What is the SMILES notation for 3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine?
The canonical SMILES for 3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine is CCOc1ccc2c(c1)Nc1ccccc1C2=C1CCN(C)CC1.
What is the InChIKey of 3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine?
The InChIKey is OFQLDZMPIOGDNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O/c1-3-24-16-8-9-18-20(14-16)22-19-7-5-4-6-17(19)21(18)15-10-12-23(2)13-11-15/h4-9,14,22H,3,10-13H2,1-2H3.
What are the key properties of 3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine?
3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine has a molecular weight of 320.44 g/mol, XLogP of 4.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-9-(1-methylpiperidin-4-ylidene)-10H-acridine is sourced from PubChem (CID 10215127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).