5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine

C15H17N3OS — CID 96710401

IUPAC5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine
SMILESCCCNc1nc2c(cc(OCC)c3ncccc32)s1
InChIInChI=1S/C15H17N3OS/c1-3-7-17-15-18-14-10-6-5-8-16-13(10)11(19-4-2)9-12(14)20-15/h5-6,8-9H,3-4,7H2,1-2H3,(H,17,18)
InChIKeyMINJWXABYLVPJD-UHFFFAOYSA-N
MW287.39 g/mol
LogP4.07
Rot. Bonds5

About 5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine

5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine (PubChem CID 96710401) has the molecular formula C15H17N3OS and a molecular weight of 287.39 g/mol. Its IUPAC name is 5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine.

Molecular Properties

Compound Name5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine
PubChem CID96710401
Molecular FormulaC15H17N3OS
Molecular Weight287.39 g/mol
Exact Mass287.11
IUPAC Name5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine
SMILESCCCNc1nc2c(cc(OCC)c3ncccc32)s1
InChIInChI=1S/C15H17N3OS/c1-3-7-17-15-18-14-10-6-5-8-16-13(10)11(19-4-2)9-12(14)20-15/h5-6,8-9H,3-4,7H2,1-2H3,(H,17,18)
InChIKeyMINJWXABYLVPJD-UHFFFAOYSA-N
XLogP4.07
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-ethoxy-N-methyl-[1,3]thiazolo[4,5-f]quinolin-2-amine
CID 96710399
4,5,6-triethoxy-N-propyl-1,3-benzothiazol-2-amine
CID 96710391
6-bromo-4-ethoxy-N-propyl-1,3-benzothiazol-2-amine
CID 82549346
5-methoxy-N-(2-methoxyethyl)benzo[e][1,3]benzothiazol-2-amine
CID 82548972
4-bromo-6-ethoxy-N-propyl-1,3-benzothiazol-2-amine
CID 82549380
N-benzyl-4,6-diethoxy-1,3-benzothiazol-2-amine
CID 82549644
(2R)-2-(4-chloro-3,5-dimethylphenoxy)-N-(5-propoxy-[1,3]thiazolo[4,5-f]quinolin-2-yl)propanamide
CID 35577154
5-(2-ethoxyphenyl)-N-propyl-1,3-thiazol-2-amine
CID 116812124
8-Ethoxy-5-quinolinesulfonic acid sodium salt monohydrate
CID 45157436
5-bromo-8-ethoxyquinoline
CID 100612531
8-ethoxy-N-[2-(2-ethoxyphenyl)ethyl]quinoline-5-sulfonamide
CID 3684734
4-methyl-2-(propylamino)benzo[e][1,3]benzothiazol-5-ol
CID 45120026

Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine?
The IUPAC name of 5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine (CID 96710401) is 5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine.
What is the SMILES notation for 5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine?
The canonical SMILES for 5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine is CCCNc1nc2c(cc(OCC)c3ncccc32)s1.
What is the InChIKey of 5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine?
The InChIKey is MINJWXABYLVPJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3OS/c1-3-7-17-15-18-14-10-6-5-8-16-13(10)11(19-4-2)9-12(14)20-15/h5-6,8-9H,3-4,7H2,1-2H3,(H,17,18).
What are the key properties of 5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine?
5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine has a molecular weight of 287.39 g/mol, XLogP of 4.07, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-N-propyl-[1,3]thiazolo[4,5-f]quinolin-2-amine is sourced from PubChem (CID 96710401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).