[4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol

C16H20N2O2 — CID 74232945

IUPAC[4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol
SMILESCc1ccc2ncccc2c1CN1CCOCC1CO
InChIInChI=1S/C16H20N2O2/c1-12-4-5-16-14(3-2-6-17-16)15(12)9-18-7-8-20-11-13(18)10-19/h2-6,13,19H,7-11H2,1H3
InChIKeyJWHRRFLSKVGOAW-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.74
Rot. Bonds3

About [4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol

[4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol (PubChem CID 74232945) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is [4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol.

Molecular Properties

Compound Name[4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol
PubChem CID74232945
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name[4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol
SMILESCc1ccc2ncccc2c1CN1CCOCC1CO
InChIInChI=1S/C16H20N2O2/c1-12-4-5-16-14(3-2-6-17-16)15(12)9-18-7-8-20-11-13(18)10-19/h2-6,13,19H,7-11H2,1H3
InChIKeyJWHRRFLSKVGOAW-UHFFFAOYSA-N
XLogP1.74
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol?
The IUPAC name of [4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol (CID 74232945) is [4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol.
What is the SMILES notation for [4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol?
The canonical SMILES for [4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol is Cc1ccc2ncccc2c1CN1CCOCC1CO.
What is the InChIKey of [4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol?
The InChIKey is JWHRRFLSKVGOAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-12-4-5-16-14(3-2-6-17-16)15(12)9-18-7-8-20-11-13(18)10-19/h2-6,13,19H,7-11H2,1H3.
What are the key properties of [4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol?
[4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol has a molecular weight of 272.35 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(6-methylquinolin-5-yl)methyl]morpholin-3-yl]methanol is sourced from PubChem (CID 74232945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).