2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol

C14H19N3O2 — CID 21002673

IUPAC2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol
SMILESCCc1ccc2ncnc(NCCOCCO)c2c1
InChIInChI=1S/C14H19N3O2/c1-2-11-3-4-13-12(9-11)14(17-10-16-13)15-5-7-19-8-6-18/h3-4,9-10,18H,2,5-8H2,1H3,(H,15,16,17)
InChIKeyDQLVSBLMZNUQSX-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.61
Rot. Bonds7

About 2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol

2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol (PubChem CID 21002673) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol
PubChem CID21002673
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol
SMILESCCc1ccc2ncnc(NCCOCCO)c2c1
InChIInChI=1S/C14H19N3O2/c1-2-11-3-4-13-12(9-11)14(17-10-16-13)15-5-7-19-8-6-18/h3-4,9-10,18H,2,5-8H2,1H3,(H,15,16,17)
InChIKeyDQLVSBLMZNUQSX-UHFFFAOYSA-N
XLogP1.61
TPSA67.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(quinazolin-4-ylamino)ethoxy]ethanol
CID 7140376
2-[2-[(7-methoxyquinazolin-4-yl)amino]ethoxy]ethanol
CID 21003121
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-ethylquinazolin-4-amine
CID 21002609
6-ethyl-N-(pyridin-4-ylmethyl)quinazolin-4-amine
CID 21002595
N-[(4-chlorophenyl)methyl]-6-ethylquinazolin-4-amine
CID 21002588
6-fluoro-N-[2-(2-methoxyethoxy)ethyl]quinazolin-4-amine
CID 133274665
2-[2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]ethoxy]ethanol
CID 80918817
2-[2-[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]ethoxy]ethanol
CID 80825941
2-[(6-methoxyquinazolin-4-yl)amino]ethanol
CID 21002851
2-[2-[(6-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethoxy]ethanol
CID 28850882
2-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethoxy]ethanol
CID 60701626
6-ethyl-N-(3-morpholin-4-ylpropyl)quinazolin-4-amine
CID 21002676

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol?
The IUPAC name of 2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol (CID 21002673) is 2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol?
The canonical SMILES for 2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol is CCc1ccc2ncnc(NCCOCCO)c2c1.
What is the InChIKey of 2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol?
The InChIKey is DQLVSBLMZNUQSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-2-11-3-4-13-12(9-11)14(17-10-16-13)15-5-7-19-8-6-18/h3-4,9-10,18H,2,5-8H2,1H3,(H,15,16,17).
What are the key properties of 2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol?
2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol has a molecular weight of 261.32 g/mol, XLogP of 1.61, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(6-ethylquinazolin-4-yl)amino]ethoxy]ethanol is sourced from PubChem (CID 21002673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).