9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine

C14H15FN2O — CID 106473134

IUPAC9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
SMILESCNc1c2c(nc3c(C)ccc(F)c13)CCOC2
InChIInChI=1S/C14H15FN2O/c1-8-3-4-10(15)12-13(8)17-11-5-6-18-7-9(11)14(12)16-2/h3-4H,5-7H2,1-2H3,(H,16,17)
InChIKeyLWEFCGLSEBNMSO-UHFFFAOYSA-N
MW246.28 g/mol
LogP2.80
Rot. Bonds1

About 9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine

9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine (PubChem CID 106473134) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is 9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine.

Molecular Properties

Compound Name9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
PubChem CID106473134
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC Name9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
SMILESCNc1c2c(nc3c(C)ccc(F)c13)CCOC2
InChIInChI=1S/C14H15FN2O/c1-8-3-4-10(15)12-13(8)17-11-5-6-18-7-9(11)14(12)16-2/h3-4H,5-7H2,1-2H3,(H,16,17)
InChIKeyLWEFCGLSEBNMSO-UHFFFAOYSA-N
XLogP2.80
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The IUPAC name of 9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine (CID 106473134) is 9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine.
What is the SMILES notation for 9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The canonical SMILES for 9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine is CNc1c2c(nc3c(C)ccc(F)c13)CCOC2.
What is the InChIKey of 9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The InChIKey is LWEFCGLSEBNMSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-8-3-4-10(15)12-13(8)17-11-5-6-18-7-9(11)14(12)16-2/h3-4H,5-7H2,1-2H3,(H,16,17).
What are the key properties of 9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine has a molecular weight of 246.28 g/mol, XLogP of 2.80, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine is sourced from PubChem (CID 106473134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).