7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol

C14H19N3O — CID 51353009

IUPAC7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol
SMILESCN(C)CCNCc1ccc2cccnc2c1O
InChIInChI=1S/C14H19N3O/c1-17(2)9-8-15-10-12-6-5-11-4-3-7-16-13(11)14(12)18/h3-7,15,18H,8-10H2,1-2H3
InChIKeyXRHFQQUAIOAZBC-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.59
Rot. Bonds5

About 7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol

7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol (PubChem CID 51353009) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol.

Molecular Properties

Compound Name7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol
PubChem CID51353009
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol
SMILESCN(C)CCNCc1ccc2cccnc2c1O
InChIInChI=1S/C14H19N3O/c1-17(2)9-8-15-10-12-6-5-11-4-3-7-16-13(11)14(12)18/h3-7,15,18H,8-10H2,1-2H3
InChIKeyXRHFQQUAIOAZBC-UHFFFAOYSA-N
XLogP1.59
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

7-propylquinolin-8-ol
CID 11604513
N'-cyclopentyl-N'-methyl-N-(quinolin-8-ylmethyl)ethane-1,2-diamine
CID 63314495
N-[[9-[[2-(dimethylamino)ethylamino]methyl]-1,10-phenanthrolin-2-yl]methyl]-N',N'-dimethylethane-1,2-diamine
CID 10595963
2-[(2-quinolin-8-ylethylamino)methyl]phenol
CID 78916472
7-[[4-[(1-hydroxynaphthalen-2-yl)methyl]piperazin-1-yl]methyl]quinolin-8-ol
CID 176719632
N-(quinolin-8-ylmethyl)butan-1-amine
CID 28613793
7-[(2-chlorophenyl)methyl]quinolin-8-ol
CID 46226670
N,N-dimethyl-2-pyridin-2-yl-6-[2-(quinolin-8-ylmethylamino)ethyl]pyrimidin-4-amine
CID 46974126
5-(quinolin-8-ylmethylamino)pentan-1-ol
CID 81427382
ethyl 4-[(8-hydroxyquinolin-7-yl)methyl]piperazine-1-carboxylate
CID 3464193
1-[2-(dimethylamino)ethyl]-3-(2-quinolin-8-yloxyethyl)urea
CID 112975956
N',N'-dimethyl-N-(2-quinolin-7-yloxyethyl)ethane-1,2-diamine
CID 107315215

Frequently Asked Questions

What is the IUPAC name of 7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol?
The IUPAC name of 7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol (CID 51353009) is 7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol.
What is the SMILES notation for 7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol?
The canonical SMILES for 7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol is CN(C)CCNCc1ccc2cccnc2c1O.
What is the InChIKey of 7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol?
The InChIKey is XRHFQQUAIOAZBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-17(2)9-8-15-10-12-6-5-11-4-3-7-16-13(11)14(12)18/h3-7,15,18H,8-10H2,1-2H3.
What are the key properties of 7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol?
7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol has a molecular weight of 245.33 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[[2-(dimethylamino)ethylamino]methyl]quinolin-8-ol is sourced from PubChem (CID 51353009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).