5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol

C17H20N2O2 — CID 171541795

IUPAC5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol
SMILESC=CCc1cc(CN2CCOCC2)c2cccnc2c1O
InChIInChI=1S/C17H20N2O2/c1-2-4-13-11-14(12-19-7-9-21-10-8-19)15-5-3-6-18-16(15)17(13)20/h2-3,5-6,11,20H,1,4,7-10,12H2
InChIKeyFDJYZLKWVHTJET-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.50
Rot. Bonds4

About 5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol

5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol (PubChem CID 171541795) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol.

Molecular Properties

Compound Name5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol
PubChem CID171541795
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol
SMILESC=CCc1cc(CN2CCOCC2)c2cccnc2c1O
InChIInChI=1S/C17H20N2O2/c1-2-4-13-11-14(12-19-7-9-21-10-8-19)15-5-3-6-18-16(15)17(13)20/h2-3,5-6,11,20H,1,4,7-10,12H2
InChIKeyFDJYZLKWVHTJET-UHFFFAOYSA-N
XLogP2.50
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

7-(morpholin-4-ylmethyl)-5-(propan-2-yloxymethyl)quinolin-8-ol
CID 23604749
5,7-bis(piperidin-1-ylmethyl)quinolin-8-ol
CID 3470863
ethyl 4-[[7-[(4-ethoxycarbonylpiperazin-1-yl)methyl]-8-hydroxyquinolin-5-yl]methyl]piperazine-1-carboxylate
CID 3471245
5-chloro-7-(pyrrolidin-1-ylmethyl)quinolin-8-ol
CID 716609
7-bromo-5-[[4-(oxolan-2-yl)piperazin-1-yl]methyl]quinolin-8-ol
CID 171541833
5-methyl-7-(piperidin-1-ylmethyl)quinolin-8-ol
CID 23765907
16-[(5-chloro-8-hydroxyquinolin-7-yl)methyl]-1-oxa-7,10,13-trithia-4,16-diazacyclooctadecan-5-one
CID 11103280
5-bromo-7-[(4-ethylpiperazin-1-yl)methyl]quinolin-8-ol
CID 18830094
5-(ethoxymethyl)-7-(piperidin-1-ylmethyl)quinolin-8-ol
CID 23604739
ethane;7-methyl-5-[(1-oxo-1,4-thiazinan-4-yl)methyl]quinolin-8-ol
CID 171541796
[5-(morpholin-4-ylmethyl)quinolin-8-yl] 4-methylbenzoate
CID 5119422
4-(quinolin-5-ylmethyl)-1,4-oxazepane
CID 29183639

Frequently Asked Questions

What is the IUPAC name of 5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol?
The IUPAC name of 5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol (CID 171541795) is 5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol.
What is the SMILES notation for 5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol?
The canonical SMILES for 5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol is C=CCc1cc(CN2CCOCC2)c2cccnc2c1O.
What is the InChIKey of 5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol?
The InChIKey is FDJYZLKWVHTJET-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-2-4-13-11-14(12-19-7-9-21-10-8-19)15-5-3-6-18-16(15)17(13)20/h2-3,5-6,11,20H,1,4,7-10,12H2.
What are the key properties of 5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol?
5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol has a molecular weight of 284.36 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(morpholin-4-ylmethyl)-7-prop-2-enylquinolin-8-ol is sourced from PubChem (CID 171541795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).