7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine

C17H22N4O2S — CID 69307282

IUPAC7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine
SMILESCCCc1nc2c(N)nc3cc(OCCOCCN)ccc3c2s1
InChIInChI=1S/C17H22N4O2S/c1-2-3-14-21-15-16(24-14)12-5-4-11(10-13(12)20-17(15)19)23-9-8-22-7-6-18/h4-5,10H,2-3,6-9,18H2,1H3,(H2,19,20)
InChIKeyHDYWXGYZBWMMSA-UHFFFAOYSA-N
MW346.46 g/mol
LogP2.73
Rot. Bonds8

About 7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine

7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine (PubChem CID 69307282) has the molecular formula C17H22N4O2S and a molecular weight of 346.46 g/mol. Its IUPAC name is 7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine.

Molecular Properties

Compound Name7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine
PubChem CID69307282
Molecular FormulaC17H22N4O2S
Molecular Weight346.46 g/mol
Exact Mass346.15
IUPAC Name7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine
SMILESCCCc1nc2c(N)nc3cc(OCCOCCN)ccc3c2s1
InChIInChI=1S/C17H22N4O2S/c1-2-3-14-21-15-16(24-14)12-5-4-11(10-13(12)20-17(15)19)23-9-8-22-7-6-18/h4-5,10H,2-3,6-9,18H2,1H3,(H2,19,20)
InChIKeyHDYWXGYZBWMMSA-UHFFFAOYSA-N
XLogP2.73
TPSA96.28 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.46
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

2-N-[2-(diethylamino)ethyl]-9-N-(3-methoxyphenyl)-[1,3]thiazolo[5,4-b]quinoline-2,9-diamine
CID 44574727
4-[4-[(2-methylpropan-2-yl)oxy]-7-[2-(2,2,2-trifluoroethylamino)ethoxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine
CID 57785721
7-[(4-Fluorophenyl)methoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine
CID 58965025
2-Ethyl-7-{[5-(trifluoromethyl)furan-2-yl]methoxy}thiazolo[4,5-c]quinolin-4-amine
CID 58965026
7-[2-(4-Fluorophenyl)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine
CID 58965036
7-[2-(4-Fluorophenyl)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinoline
CID 67392933
7-(4-Fluorobenzyloxy)-2-propylthiazolo[4,5-c]quinoline
CID 67393000
4-[7-[2-(fluoromethylamino)ethoxy]-4-[(2-methylpropan-2-yl)oxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine
CID 89014631
4-[4-ethoxy-7-[2-(2,2,2-trifluoroethylamino)ethoxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine
CID 89016177
4-[4-methoxy-7-[2-(2,2,2-trifluoroethylamino)ethoxy]quinolin-2-yl]-N-propan-2-yl-1,3-thiazol-2-amine
CID 89502363
[7-(2-Morpholin-4-ylethoxy)-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl] hypofluorite
CID 145545640
[7-(2-Amino-2-methylpropoxy)-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl] hypofluorite
CID 145546284

Frequently Asked Questions

What is the IUPAC name of 7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine?
The IUPAC name of 7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine (CID 69307282) is 7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine.
What is the SMILES notation for 7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine?
The canonical SMILES for 7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine is CCCc1nc2c(N)nc3cc(OCCOCCN)ccc3c2s1.
What is the InChIKey of 7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine?
The InChIKey is HDYWXGYZBWMMSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O2S/c1-2-3-14-21-15-16(24-14)12-5-4-11(10-13(12)20-17(15)19)23-9-8-22-7-6-18/h4-5,10H,2-3,6-9,18H2,1H3,(H2,19,20).
What are the key properties of 7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine?
7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine has a molecular weight of 346.46 g/mol, XLogP of 2.73, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-(2-aminoethoxy)ethoxy]-2-propyl-[1,3]thiazolo[4,5-c]quinolin-4-amine is sourced from PubChem (CID 69307282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).