4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine

C20H24N2O — CID 127049840

IUPAC4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine
SMILESCc1nc2ccc(N3CCOCC3)cc2cc1C1=CCCCC1
InChIInChI=1S/C20H24N2O/c1-15-19(16-5-3-2-4-6-16)14-17-13-18(7-8-20(17)21-15)22-9-11-23-12-10-22/h5,7-8,13-14H,2-4,6,9-12H2,1H3
InChIKeyVMHYJXSKIXKQMV-UHFFFAOYSA-N
MW308.43 g/mol
LogP4.34
Rot. Bonds2

About 4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine

4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine (PubChem CID 127049840) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is 4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine.

Molecular Properties

Compound Name4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine
PubChem CID127049840
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC Name4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine
SMILESCc1nc2ccc(N3CCOCC3)cc2cc1C1=CCCCC1
InChIInChI=1S/C20H24N2O/c1-15-19(16-5-3-2-4-6-16)14-17-13-18(7-8-20(17)21-15)22-9-11-23-12-10-22/h5,7-8,13-14H,2-4,6,9-12H2,1H3
InChIKeyVMHYJXSKIXKQMV-UHFFFAOYSA-N
XLogP4.34
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine?
The IUPAC name of 4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine (CID 127049840) is 4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine.
What is the SMILES notation for 4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine?
The canonical SMILES for 4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine is Cc1nc2ccc(N3CCOCC3)cc2cc1C1=CCCCC1.
What is the InChIKey of 4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine?
The InChIKey is VMHYJXSKIXKQMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O/c1-15-19(16-5-3-2-4-6-16)14-17-13-18(7-8-20(17)21-15)22-9-11-23-12-10-22/h5,7-8,13-14H,2-4,6,9-12H2,1H3.
What are the key properties of 4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine?
4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine has a molecular weight of 308.43 g/mol, XLogP of 4.34, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(cyclohexen-1-yl)-2-methylquinolin-6-yl]morpholine is sourced from PubChem (CID 127049840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).