N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine

C15H13F3N2O — CID 106473275

IUPACN-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
SMILESFc1cc2nc3c(c(NC4CC4)c2c(F)c1F)COCC3
InChIInChI=1S/C15H13F3N2O/c16-9-5-11-12(14(18)13(9)17)15(19-7-1-2-7)8-6-21-4-3-10(8)20-11/h5,7H,1-4,6H2,(H,19,20)
InChIKeyLTMBSZUURILVBD-UHFFFAOYSA-N
MW294.28 g/mol
LogP3.30
Rot. Bonds2

About N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine

N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine (PubChem CID 106473275) has the molecular formula C15H13F3N2O and a molecular weight of 294.28 g/mol. Its IUPAC name is N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine.

Molecular Properties

Compound NameN-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
PubChem CID106473275
Molecular FormulaC15H13F3N2O
Molecular Weight294.28 g/mol
Exact Mass294.10
IUPAC NameN-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
SMILESFc1cc2nc3c(c(NC4CC4)c2c(F)c1F)COCC3
InChIInChI=1S/C15H13F3N2O/c16-9-5-11-12(14(18)13(9)17)15(19-7-1-2-7)8-6-21-4-3-10(8)20-11/h5,7H,1-4,6H2,(H,19,20)
InChIKeyLTMBSZUURILVBD-UHFFFAOYSA-N
XLogP3.30
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.28
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Analyze N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine with MolForge

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Related Compounds

7,9-dichloro-N-cyclopropyl-8-fluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 107578873
8-bromo-N-cyclopropyl-7,9-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 107578774
N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473014
N-cyclopropyl-6-methoxy-9-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473061
8-ethoxy-7-fluoro-N-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473352
7-fluoro-8-methyl-N-propyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473331
6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473321
9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473134
8,10-dichloro-7-fluoro-3,4-dihydro-1H-pyrano[4,3-b]quinoline
CID 106471040
10-chloro-6,7,8-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinoline
CID 106471008
8-ethoxy-N-ethyl-7-fluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473350
(7,9-dichloro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-yl)hydrazine
CID 106473710

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The IUPAC name of N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine (CID 106473275) is N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine.
What is the SMILES notation for N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The canonical SMILES for N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine is Fc1cc2nc3c(c(NC4CC4)c2c(F)c1F)COCC3.
What is the InChIKey of N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The InChIKey is LTMBSZUURILVBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N2O/c16-9-5-11-12(14(18)13(9)17)15(19-7-1-2-7)8-6-21-4-3-10(8)20-11/h5,7H,1-4,6H2,(H,19,20).
What are the key properties of N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine has a molecular weight of 294.28 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine is sourced from PubChem (CID 106473275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).