1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine

C15H18N2 — CID 164613000

IUPAC1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
SMILESCc1cccc2nc3c(c(N)c12)CCCCC3
InChIInChI=1S/C15H18N2/c1-10-6-5-9-13-14(10)15(16)11-7-3-2-4-8-12(11)17-13/h5-6,9H,2-4,7-8H2,1H3,(H2,16,17)
InChIKeyOPNOYFYMEWJEMI-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.39
Rot. Bonds

About 1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine

1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine (PubChem CID 164613000) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine.

Molecular Properties

Compound Name1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
PubChem CID164613000
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
SMILESCc1cccc2nc3c(c(N)c12)CCCCC3
InChIInChI=1S/C15H18N2/c1-10-6-5-9-13-14(10)15(16)11-7-3-2-4-8-12(11)17-13/h5-6,9H,2-4,7-8H2,1H3,(H2,16,17)
InChIKeyOPNOYFYMEWJEMI-UHFFFAOYSA-N
XLogP3.39
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The IUPAC name of 1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine (CID 164613000) is 1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine.
What is the SMILES notation for 1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The canonical SMILES for 1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine is Cc1cccc2nc3c(c(N)c12)CCCCC3.
What is the InChIKey of 1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The InChIKey is OPNOYFYMEWJEMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-10-6-5-9-13-14(10)15(16)11-7-3-2-4-8-12(11)17-13/h5-6,9H,2-4,7-8H2,1H3,(H2,16,17).
What are the key properties of 1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine has a molecular weight of 226.32 g/mol, XLogP of 3.39, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine is sourced from PubChem (CID 164613000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).