N-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

C14H13F3N2O — CID 62203095

IUPACN-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESCNc1c2c(nc3ccc(OC(F)(F)F)cc13)CCC2
InChIInChI=1S/C14H13F3N2O/c1-18-13-9-3-2-4-11(9)19-12-6-5-8(7-10(12)13)20-14(15,16)17/h5-7H,2-4H2,1H3,(H,18,19)
InChIKeyCPICRCDOPQTTSP-UHFFFAOYSA-N
MW282.26 g/mol
LogP3.66
Rot. Bonds2

About N-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

N-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (PubChem CID 62203095) has the molecular formula C14H13F3N2O and a molecular weight of 282.26 g/mol. Its IUPAC name is N-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.

Molecular Properties

Compound NameN-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
PubChem CID62203095
Molecular FormulaC14H13F3N2O
Molecular Weight282.26 g/mol
Exact Mass282.10
IUPAC NameN-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESCNc1c2c(nc3ccc(OC(F)(F)F)cc13)CCC2
InChIInChI=1S/C14H13F3N2O/c1-18-13-9-3-2-4-11(9)19-12-6-5-8(7-10(12)13)20-14(15,16)17/h5-7H,2-4H2,1H3,(H,18,19)
InChIKeyCPICRCDOPQTTSP-UHFFFAOYSA-N
XLogP3.66
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.26
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-iodo-N-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 62202165
7-chloro-N-methyl-1,2,3,4-tetrahydroacridin-9-amine
CID 62202376
N-(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)hydroxylamine
CID 21192892
6-fluoro-N-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 103996137
N-benzyl-7-methoxy-1,2,3,4-tetrahydroacridin-9-amine
CID 10710689
4-[(7-methoxy-1,2,3,4-tetrahydroacridin-9-yl)amino]-2,2-dimethylbutan-1-ol
CID 166382730
N-[2-(2-fluoro-4-methoxyphenyl)ethyl]-7-methoxy-1,2,3,4-tetrahydroacridin-9-amine
CID 167913440
N-ethyl-7-phenylmethoxy-1,2,3,4-tetrahydroacridin-9-amine
CID 113232551
5,7-difluoro-N-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 55045655
9-chloro-7-(difluoromethoxy)-1,2,3,4-tetrahydroacridine
CID 55187703
(7-methoxy-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methanethiol
CID 82451972
N,2-diethyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
CID 63480907

Frequently Asked Questions

What is the IUPAC name of N-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The IUPAC name of N-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (CID 62203095) is N-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.
What is the SMILES notation for N-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The canonical SMILES for N-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is CNc1c2c(nc3ccc(OC(F)(F)F)cc13)CCC2.
What is the InChIKey of N-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The InChIKey is CPICRCDOPQTTSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2O/c1-18-13-9-3-2-4-11(9)19-12-6-5-8(7-10(12)13)20-14(15,16)17/h5-7H,2-4H2,1H3,(H,18,19).
What are the key properties of N-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
N-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine has a molecular weight of 282.26 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-7-(trifluoromethoxy)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is sourced from PubChem (CID 62203095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).