4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine

C18H22N2O — CID 22099

IUPAC4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine
SMILESc1ccc2c(N3CCOCC3)c3c(nc2c1)CCCCC3
InChIInChI=1S/C18H22N2O/c1-2-6-14-16(8-3-1)19-17-9-5-4-7-15(17)18(14)20-10-12-21-13-11-20/h4-5,7,9H,1-3,6,8,10-13H2
InChIKeyBYLRUJWQQHVPTM-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.34
Rot. Bonds1

About 4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine

4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine (PubChem CID 22099) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine.

Molecular Properties

Compound Name4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine
PubChem CID22099
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine
SMILESc1ccc2c(N3CCOCC3)c3c(nc2c1)CCCCC3
InChIInChI=1S/C18H22N2O/c1-2-6-14-16(8-3-1)19-17-9-5-4-7-15(17)18(14)20-10-12-21-13-11-20/h4-5,7,9H,1-3,6,8,10-13H2
InChIKeyBYLRUJWQQHVPTM-UHFFFAOYSA-N
XLogP3.34
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine?
The IUPAC name of 4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine (CID 22099) is 4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine.
What is the SMILES notation for 4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine?
The canonical SMILES for 4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine is c1ccc2c(N3CCOCC3)c3c(nc2c1)CCCCC3.
What is the InChIKey of 4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine?
The InChIKey is BYLRUJWQQHVPTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-2-6-14-16(8-3-1)19-17-9-5-4-7-15(17)18(14)20-10-12-21-13-11-20/h4-5,7,9H,1-3,6,8,10-13H2.
What are the key properties of 4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine?
4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine has a molecular weight of 282.39 g/mol, XLogP of 3.34, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-yl)morpholine is sourced from PubChem (CID 22099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).