4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine

C14H14N4OS — CID 65336420

IUPAC4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine
SMILESCc1ncsc1CCOc1ncnc2cc(N)ccc12
InChIInChI=1S/C14H14N4OS/c1-9-13(20-8-18-9)4-5-19-14-11-3-2-10(15)6-12(11)16-7-17-14/h2-3,6-8H,4-5,15H2,1H3
InChIKeyYBECDVLCYLKWSK-UHFFFAOYSA-N
MW286.36 g/mol
LogP2.60
Rot. Bonds4

About 4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine

4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine (PubChem CID 65336420) has the molecular formula C14H14N4OS and a molecular weight of 286.36 g/mol. Its IUPAC name is 4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine.

Molecular Properties

Compound Name4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine
PubChem CID65336420
Molecular FormulaC14H14N4OS
Molecular Weight286.36 g/mol
Exact Mass286.09
IUPAC Name4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine
SMILESCc1ncsc1CCOc1ncnc2cc(N)ccc12
InChIInChI=1S/C14H14N4OS/c1-9-13(20-8-18-9)4-5-19-14-11-3-2-10(15)6-12(11)16-7-17-14/h2-3,6-8H,4-5,15H2,1H3
InChIKeyYBECDVLCYLKWSK-UHFFFAOYSA-N
XLogP2.60
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine
CID 62475742
4-[2-(dimethylamino)ethoxy]quinazolin-7-amine
CID 65336522
4-[3-(dimethylamino)propoxy]quinazolin-7-amine
CID 65336571
4-methylquinazolin-7-amine
CID 90920738
[1-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]isoquinolin-4-yl]methanamine
CID 106777282
5-amino-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridine-3-carbonitrile
CID 54860959
3-bromo-4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxymethyl]aniline
CID 60790887
O-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]hydroxylamine
CID 11228942
methyl 3-amino-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]benzoate
CID 115935655
4-ethoxy-3-[2-(4-methyl-1,3-thiazol-5-yl)ethoxymethyl]aniline
CID 43260074
4-propoxyquinazolin-6-amine
CID 64587338
2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]-1,3-thiazol-5-amine
CID 102769344

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine?
The IUPAC name of 4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine (CID 65336420) is 4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine.
What is the SMILES notation for 4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine?
The canonical SMILES for 4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine is Cc1ncsc1CCOc1ncnc2cc(N)ccc12.
What is the InChIKey of 4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine?
The InChIKey is YBECDVLCYLKWSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4OS/c1-9-13(20-8-18-9)4-5-19-14-11-3-2-10(15)6-12(11)16-7-17-14/h2-3,6-8H,4-5,15H2,1H3.
What are the key properties of 4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine?
4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine has a molecular weight of 286.36 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]quinazolin-7-amine is sourced from PubChem (CID 65336420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).