8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine

C15H17ClN2O — CID 106473178

IUPAC8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
SMILESCCNc1c2c(nc3c(C)cc(Cl)cc13)CCOC2
InChIInChI=1S/C15H17ClN2O/c1-3-17-15-11-7-10(16)6-9(2)14(11)18-13-4-5-19-8-12(13)15/h6-7H,3-5,8H2,1-2H3,(H,17,18)
InChIKeyWYFPLTMZJBDTQL-UHFFFAOYSA-N
MW276.77 g/mol
LogP3.70
Rot. Bonds2

About 8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine

8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine (PubChem CID 106473178) has the molecular formula C15H17ClN2O and a molecular weight of 276.77 g/mol. Its IUPAC name is 8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine.

Molecular Properties

Compound Name8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
PubChem CID106473178
Molecular FormulaC15H17ClN2O
Molecular Weight276.77 g/mol
Exact Mass276.10
IUPAC Name8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
SMILESCCNc1c2c(nc3c(C)cc(Cl)cc13)CCOC2
InChIInChI=1S/C15H17ClN2O/c1-3-17-15-11-7-10(16)6-9(2)14(11)18-13-4-5-19-8-12(13)15/h6-7H,3-5,8H2,1-2H3,(H,17,18)
InChIKeyWYFPLTMZJBDTQL-UHFFFAOYSA-N
XLogP3.70
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The IUPAC name of 8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine (CID 106473178) is 8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine.
What is the SMILES notation for 8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The canonical SMILES for 8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine is CCNc1c2c(nc3c(C)cc(Cl)cc13)CCOC2.
What is the InChIKey of 8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The InChIKey is WYFPLTMZJBDTQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O/c1-3-17-15-11-7-10(16)6-9(2)14(11)18-13-4-5-19-8-12(13)15/h6-7H,3-5,8H2,1-2H3,(H,17,18).
What are the key properties of 8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine has a molecular weight of 276.77 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine is sourced from PubChem (CID 106473178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).