4-(4-isoquinolin-6-yloxycyclohexyl)morpholine

C19H24N2O2 — CID 59268507

IUPAC4-(4-isoquinolin-6-yloxycyclohexyl)morpholine
SMILESc1cc2cc(OC3CCC(N4CCOCC4)CC3)ccc2cn1
InChIInChI=1S/C19H24N2O2/c1-4-19(13-15-7-8-20-14-16(1)15)23-18-5-2-17(3-6-18)21-9-11-22-12-10-21/h1,4,7-8,13-14,17-18H,2-3,5-6,9-12H2
InChIKeyALNGRWSMVPKNCU-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.26
Rot. Bonds3

About 4-(4-isoquinolin-6-yloxycyclohexyl)morpholine

4-(4-isoquinolin-6-yloxycyclohexyl)morpholine (PubChem CID 59268507) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 4-(4-isoquinolin-6-yloxycyclohexyl)morpholine.

Molecular Properties

Compound Name4-(4-isoquinolin-6-yloxycyclohexyl)morpholine
PubChem CID59268507
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name4-(4-isoquinolin-6-yloxycyclohexyl)morpholine
SMILESc1cc2cc(OC3CCC(N4CCOCC4)CC3)ccc2cn1
InChIInChI=1S/C19H24N2O2/c1-4-19(13-15-7-8-20-14-16(1)15)23-18-5-2-17(3-6-18)21-9-11-22-12-10-21/h1,4,7-8,13-14,17-18H,2-3,5-6,9-12H2
InChIKeyALNGRWSMVPKNCU-UHFFFAOYSA-N
XLogP3.26
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4-isoquinolin-6-yloxycyclohexyl)morpholine?
The IUPAC name of 4-(4-isoquinolin-6-yloxycyclohexyl)morpholine (CID 59268507) is 4-(4-isoquinolin-6-yloxycyclohexyl)morpholine.
What is the SMILES notation for 4-(4-isoquinolin-6-yloxycyclohexyl)morpholine?
The canonical SMILES for 4-(4-isoquinolin-6-yloxycyclohexyl)morpholine is c1cc2cc(OC3CCC(N4CCOCC4)CC3)ccc2cn1.
What is the InChIKey of 4-(4-isoquinolin-6-yloxycyclohexyl)morpholine?
The InChIKey is ALNGRWSMVPKNCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-4-19(13-15-7-8-20-14-16(1)15)23-18-5-2-17(3-6-18)21-9-11-22-12-10-21/h1,4,7-8,13-14,17-18H,2-3,5-6,9-12H2.
What are the key properties of 4-(4-isoquinolin-6-yloxycyclohexyl)morpholine?
4-(4-isoquinolin-6-yloxycyclohexyl)morpholine has a molecular weight of 312.41 g/mol, XLogP of 3.26, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-isoquinolin-6-yloxycyclohexyl)morpholine is sourced from PubChem (CID 59268507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).