2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine

C14H14Cl2N2 — CID 63480718

IUPAC2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
SMILESNc1c2c(nc3c(Cl)cc(Cl)cc13)CCCCC2
InChIInChI=1S/C14H14Cl2N2/c15-8-6-10-13(17)9-4-2-1-3-5-12(9)18-14(10)11(16)7-8/h6-7H,1-5H2,(H2,17,18)
InChIKeyIWMVIMXKIPYNDO-UHFFFAOYSA-N
MW281.19 g/mol
LogP4.39
Rot. Bonds

About 2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine

2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine (PubChem CID 63480718) has the molecular formula C14H14Cl2N2 and a molecular weight of 281.19 g/mol. Its IUPAC name is 2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine.

Molecular Properties

Compound Name2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
PubChem CID63480718
Molecular FormulaC14H14Cl2N2
Molecular Weight281.19 g/mol
Exact Mass280.05
IUPAC Name2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
SMILESNc1c2c(nc3c(Cl)cc(Cl)cc13)CCCCC2
InChIInChI=1S/C14H14Cl2N2/c15-8-6-10-13(17)9-4-2-1-3-5-12(9)18-14(10)11(16)7-8/h6-7H,1-5H2,(H2,17,18)
InChIKeyIWMVIMXKIPYNDO-UHFFFAOYSA-N
XLogP4.39
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.19
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-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 2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The IUPAC name of 2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine (CID 63480718) is 2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine.
What is the SMILES notation for 2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The canonical SMILES for 2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine is Nc1c2c(nc3c(Cl)cc(Cl)cc13)CCCCC2.
What is the InChIKey of 2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The InChIKey is IWMVIMXKIPYNDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N2/c15-8-6-10-13(17)9-4-2-1-3-5-12(9)18-14(10)11(16)7-8/h6-7H,1-5H2,(H2,17,18).
What are the key properties of 2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine has a molecular weight of 281.19 g/mol, XLogP of 4.39, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine is sourced from PubChem (CID 63480718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).