N-ethyl-2-quinazolin-4-yloxyethanamine

C12H15N3O — CID 62347961

IUPACN-ethyl-2-quinazolin-4-yloxyethanamine
SMILESCCNCCOc1ncnc2ccccc12
InChIInChI=1S/C12H15N3O/c1-2-13-7-8-16-12-10-5-3-4-6-11(10)14-9-15-12/h3-6,9,13H,2,7-8H2,1H3
InChIKeyFKQLNUKGCXFCCT-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.62
Rot. Bonds5

About N-ethyl-2-quinazolin-4-yloxyethanamine

N-ethyl-2-quinazolin-4-yloxyethanamine (PubChem CID 62347961) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is N-ethyl-2-quinazolin-4-yloxyethanamine.

Molecular Properties

Compound NameN-ethyl-2-quinazolin-4-yloxyethanamine
PubChem CID62347961
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC NameN-ethyl-2-quinazolin-4-yloxyethanamine
SMILESCCNCCOc1ncnc2ccccc12
InChIInChI=1S/C12H15N3O/c1-2-13-7-8-16-12-10-5-3-4-6-11(10)14-9-15-12/h3-6,9,13H,2,7-8H2,1H3
InChIKeyFKQLNUKGCXFCCT-UHFFFAOYSA-N
XLogP1.62
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-ethoxyquinazoline
CID 589708
4-[2-(2,3,6-trimethylphenoxy)ethoxy]quinazoline
CID 3820862
4-(5-bromopentoxy)quinazoline
CID 163216994
4-butan-2-yloxyquinazoline
CID 121007235
4-[3-(4-chloro-2,6-dimethylphenoxy)propoxy]quinazoline
CID 3848714
N-methyl-2-quinazolin-4-yloxyacetamide
CID 2422162
N-(2-phenoxyethyl)-2-quinazolin-4-yloxyacetamide
CID 78801696
4-[(2-methylphenyl)methoxy]quinazoline
CID 112787376
quinazolin-4-yl hypofluorite
CID 143671515
2-ethoxy-N-(2-quinazolin-4-ylsulfanylethyl)ethanamine
CID 62577011
4-[2-[2-(2-fluorophenoxy)ethoxy]ethoxy]quinazoline
CID 5343268
4-[2-[4-(4-fluorophenyl)phenyl]ethoxy]quinazoline
CID 54258705

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-quinazolin-4-yloxyethanamine?
The IUPAC name of N-ethyl-2-quinazolin-4-yloxyethanamine (CID 62347961) is N-ethyl-2-quinazolin-4-yloxyethanamine.
What is the SMILES notation for N-ethyl-2-quinazolin-4-yloxyethanamine?
The canonical SMILES for N-ethyl-2-quinazolin-4-yloxyethanamine is CCNCCOc1ncnc2ccccc12.
What is the InChIKey of N-ethyl-2-quinazolin-4-yloxyethanamine?
The InChIKey is FKQLNUKGCXFCCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-2-13-7-8-16-12-10-5-3-4-6-11(10)14-9-15-12/h3-6,9,13H,2,7-8H2,1H3.
What are the key properties of N-ethyl-2-quinazolin-4-yloxyethanamine?
N-ethyl-2-quinazolin-4-yloxyethanamine has a molecular weight of 217.27 g/mol, XLogP of 1.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-quinazolin-4-yloxyethanamine is sourced from PubChem (CID 62347961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).