9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile

C22H28N4O — CID 166560815

IUPAC9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile
SMILESCCN1CCC(Nc2c3c(nc4cc(C#N)c(OC)cc24)CCCC3)CC1
InChIInChI=1S/C22H28N4O/c1-3-26-10-8-16(9-11-26)24-22-17-6-4-5-7-19(17)25-20-12-15(14-23)21(27-2)13-18(20)22/h12-13,16H,3-11H2,1-2H3,(H,24,25)
InChIKeyJQZWSHWKDNHZRJ-UHFFFAOYSA-N
MW364.49 g/mol
LogP3.89
Rot. Bonds4

About 9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile

9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile (PubChem CID 166560815) has the molecular formula C22H28N4O and a molecular weight of 364.49 g/mol. Its IUPAC name is 9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile.

Molecular Properties

Compound Name9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile
PubChem CID166560815
Molecular FormulaC22H28N4O
Molecular Weight364.49 g/mol
Exact Mass364.23
IUPAC Name9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile
SMILESCCN1CCC(Nc2c3c(nc4cc(C#N)c(OC)cc24)CCCC3)CC1
InChIInChI=1S/C22H28N4O/c1-3-26-10-8-16(9-11-26)24-22-17-6-4-5-7-19(17)25-20-12-15(14-23)21(27-2)13-18(20)22/h12-13,16H,3-11H2,1-2H3,(H,24,25)
InChIKeyJQZWSHWKDNHZRJ-UHFFFAOYSA-N
XLogP3.89
TPSA61.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-9-[(1-methylpiperidin-4-yl)amino]-5,6,7,8-tetrahydroacridine-3-carbonitrile
CID 166560629
6-ethoxy-N-(1-ethylpiperidin-4-yl)-7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 166560804
3-[4-[(2,3-dimethoxy-6,7,8,9,10,11-hexahydrocycloocta[b]quinolin-12-yl)amino]piperidin-1-yl]propanenitrile
CID 166560557
2-[4-[(6,7-dimethoxy-1,2,3,4-tetrahydroacridin-9-yl)amino]piperidin-1-yl]ethanol
CID 147327134
6-ethyl-7-methoxy-N-[1-(2-methoxyethyl)piperidin-4-yl]-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 166560652
6-chloro-7-methoxy-N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroacridin-9-amine
CID 166560741
N-cyclobutyl-7-methoxy-6-(3-pyrrolidin-1-ylpropoxy)-1,2,3,4-tetrahydroacridin-9-amine
CID 175854650
N-[(3S)-1-cyclobutylpyrrolidin-3-yl]-6,7-dimethoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 166560553
N-[1-(3-chlorophenyl)piperidin-4-yl]-6,7-dimethoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 153164660
N-(1-cyclopropylpiperidin-4-yl)-8,9-dimethoxy-1,2,4,5-tetrahydrooxepino[4,5-b]quinolin-11-amine
CID 148717078
4-[[7-methoxy-6-(3-pyrrolidin-1-ylpropoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl]amino]-1-methylpiperidin-2-one
CID 130345852
1-[4-[(6,7-dimethoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)amino]piperidin-1-yl]-2-phenylmethoxyethanone
CID 166560744

Frequently Asked Questions

What is the IUPAC name of 9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile?
The IUPAC name of 9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile (CID 166560815) is 9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile.
What is the SMILES notation for 9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile?
The canonical SMILES for 9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile is CCN1CCC(Nc2c3c(nc4cc(C#N)c(OC)cc24)CCCC3)CC1.
What is the InChIKey of 9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile?
The InChIKey is JQZWSHWKDNHZRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O/c1-3-26-10-8-16(9-11-26)24-22-17-6-4-5-7-19(17)25-20-12-15(14-23)21(27-2)13-18(20)22/h12-13,16H,3-11H2,1-2H3,(H,24,25).
What are the key properties of 9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile?
9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile has a molecular weight of 364.49 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(1-ethylpiperidin-4-yl)amino]-2-methoxy-5,6,7,8-tetrahydroacridine-3-carbonitrile is sourced from PubChem (CID 166560815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).