4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine

C14H17N3S — CID 65484060

IUPAC4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine
SMILESNc1nc(CCN2CCCc3ccccc32)cs1
InChIInChI=1S/C14H17N3S/c15-14-16-12(10-18-14)7-9-17-8-3-5-11-4-1-2-6-13(11)17/h1-2,4,6,10H,3,5,7-9H2,(H2,15,16)
InChIKeyUVMNFWGLLYVCCC-UHFFFAOYSA-N
MW259.38 g/mol
LogP2.72
Rot. Bonds3

About 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine

4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine (PubChem CID 65484060) has the molecular formula C14H17N3S and a molecular weight of 259.38 g/mol. Its IUPAC name is 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine
PubChem CID65484060
Molecular FormulaC14H17N3S
Molecular Weight259.38 g/mol
Exact Mass259.11
IUPAC Name4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine
SMILESNc1nc(CCN2CCCc3ccccc32)cs1
InChIInChI=1S/C14H17N3S/c15-14-16-12(10-18-14)7-9-17-8-3-5-11-4-1-2-6-13(11)17/h1-2,4,6,10H,3,5,7-9H2,(H2,15,16)
InChIKeyUVMNFWGLLYVCCC-UHFFFAOYSA-N
XLogP2.72
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.38
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(chloromethyl)-2-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazole
CID 43320468
4-[2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine
CID 65485622
3-(2-amino-1,3-thiazol-4-yl)-1-(2,3-dihydroindol-1-yl)propan-1-one
CID 110330168
4-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]-1,3-thiazol-2-amine
CID 65483300
1-(2-pyrrolidin-1-ylethyl)-3,4-dihydro-2H-quinoline
CID 59807075
3-(2-amino-1,3-thiazol-4-yl)-1-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)propan-1-one
CID 162626101
6-(3,4-dihydro-2H-quinolin-1-yl)hexan-1-amine
CID 13472128
8-(3,4-dihydro-2H-quinolin-1-yl)octan-1-amine
CID 13472131
4-(3,4-dihydro-2H-quinolin-1-ylmethyl)-2-(2-methoxyphenyl)-1,3-thiazole
CID 4795881
1-(3-pyrrolidin-1-ylpropyl)-3,4-dihydro-2H-quinoline
CID 82085595
2-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]guanidine
CID 82285615
4-[2-(2,5-dihydropyrrol-1-yl)ethyl]-1,3-thiazol-2-amine
CID 130735866

Frequently Asked Questions

What is the IUPAC name of 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine?
The IUPAC name of 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine (CID 65484060) is 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine is Nc1nc(CCN2CCCc3ccccc32)cs1.
What is the InChIKey of 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine?
The InChIKey is UVMNFWGLLYVCCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3S/c15-14-16-12(10-18-14)7-9-17-8-3-5-11-4-1-2-6-13(11)17/h1-2,4,6,10H,3,5,7-9H2,(H2,15,16).
What are the key properties of 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine?
4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine has a molecular weight of 259.38 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3,4-dihydro-2H-quinolin-1-yl)ethyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 65484060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).