2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol

C17H26N2O2 — CID 79733286

IUPAC2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol
SMILESCC(C)(C(O)C1CCCc2cccnc21)N1CCOCC1
InChIInChI=1S/C17H26N2O2/c1-17(2,19-9-11-21-12-10-19)16(20)14-7-3-5-13-6-4-8-18-15(13)14/h4,6,8,14,16,20H,3,5,7,9-12H2,1-2H3
InChIKeyXSOQHEJQCLQBBR-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.97
Rot. Bonds3

About 2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol

2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol (PubChem CID 79733286) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol.

Molecular Properties

Compound Name2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol
PubChem CID79733286
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol
SMILESCC(C)(C(O)C1CCCc2cccnc21)N1CCOCC1
InChIInChI=1S/C17H26N2O2/c1-17(2,19-9-11-21-12-10-19)16(20)14-7-3-5-13-6-4-8-18-15(13)14/h4,6,8,14,16,20H,3,5,7,9-12H2,1-2H3
InChIKeyXSOQHEJQCLQBBR-UHFFFAOYSA-N
XLogP1.97
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol?
The IUPAC name of 2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol (CID 79733286) is 2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol.
What is the SMILES notation for 2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol?
The canonical SMILES for 2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol is CC(C)(C(O)C1CCCc2cccnc21)N1CCOCC1.
What is the InChIKey of 2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol?
The InChIKey is XSOQHEJQCLQBBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-17(2,19-9-11-21-12-10-19)16(20)14-7-3-5-13-6-4-8-18-15(13)14/h4,6,8,14,16,20H,3,5,7,9-12H2,1-2H3.
What are the key properties of 2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol?
2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol has a molecular weight of 290.41 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-morpholin-4-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol is sourced from PubChem (CID 79733286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).