N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine

C18H22N2O — CID 82451891

IUPACN-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine
SMILESCOc1cccc2c(CNC3CC3)c3c(nc12)CCCC3
InChIInChI=1S/C18H22N2O/c1-21-17-8-4-6-14-15(11-19-12-9-10-12)13-5-2-3-7-16(13)20-18(14)17/h4,6,8,12,19H,2-3,5,7,9-11H2,1H3
InChIKeyUKCMTJSHUBHQHA-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.37
Rot. Bonds4

About N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine

N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine (PubChem CID 82451891) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine
PubChem CID82451891
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC NameN-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine
SMILESCOc1cccc2c(CNC3CC3)c3c(nc12)CCCC3
InChIInChI=1S/C18H22N2O/c1-21-17-8-4-6-14-15(11-19-12-9-10-12)13-5-2-3-7-16(13)20-18(14)17/h4,6,8,12,19H,2-3,5,7,9-11H2,1H3
InChIKeyUKCMTJSHUBHQHA-UHFFFAOYSA-N
XLogP3.37
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]propan-2-amine
CID 82451889
N-[(5-fluoro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]cyclopropanamine
CID 82451061
1-(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)ethanamine
CID 82451910
1-(2-ethyl-6-methoxy-3,4-dihydro-1H-benzo[b][1,6]naphthyridin-10-yl)-N-methylmethanamine
CID 82451939
N-[(5-chloro-1,2,3,4-tetrahydroacridin-9-yl)methyl]ethanamine
CID 82451207
2-methyl-N-[(5-methyl-1,2,3,4-tetrahydroacridin-9-yl)methyl]propan-1-amine
CID 82450020
N-[(5-fluoro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]-2-methoxyethanamine
CID 82451066
N-[(2,3-dimethoxyphenyl)methyl]cyclopropanamine;hydrochloride
CID 17295654
4-(5-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine
CID 82451876
N-[(5-ethyl-1,2,3,4-tetrahydroacridin-9-yl)methyl]-2-methylpropan-1-amine
CID 82450145
5-(5-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3,4-thiadiazol-2-amine
CID 82451875
N-[(5-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine
CID 82450215

Frequently Asked Questions

What is the IUPAC name of N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine (CID 82451891) is N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine is COc1cccc2c(CNC3CC3)c3c(nc12)CCCC3.
What is the InChIKey of N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine?
The InChIKey is UKCMTJSHUBHQHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-21-17-8-4-6-14-15(11-19-12-9-10-12)13-5-2-3-7-16(13)20-18(14)17/h4,6,8,12,19H,2-3,5,7,9-11H2,1H3.
What are the key properties of N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine?
N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine has a molecular weight of 282.39 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]cyclopropanamine is sourced from PubChem (CID 82451891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).