N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine

C15H15N3S — CID 116811999

IUPACN-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine
SMILESCCNc1ncc(-c2cc(C)nc3ccccc23)s1
InChIInChI=1S/C15H15N3S/c1-3-16-15-17-9-14(19-15)12-8-10(2)18-13-7-5-4-6-11(12)13/h4-9H,3H2,1-2H3,(H,16,17)
InChIKeyUSJITOIBYZYIFR-UHFFFAOYSA-N
MW269.37 g/mol
LogP4.10
Rot. Bonds3

About N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine

N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine (PubChem CID 116811999) has the molecular formula C15H15N3S and a molecular weight of 269.37 g/mol. Its IUPAC name is N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine
PubChem CID116811999
Molecular FormulaC15H15N3S
Molecular Weight269.37 g/mol
Exact Mass269.10
IUPAC NameN-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine
SMILESCCNc1ncc(-c2cc(C)nc3ccccc23)s1
InChIInChI=1S/C15H15N3S/c1-3-16-15-17-9-14(19-15)12-8-10(2)18-13-7-5-4-6-11(12)13/h4-9H,3H2,1-2H3,(H,16,17)
InChIKeyUSJITOIBYZYIFR-UHFFFAOYSA-N
XLogP4.10
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-chlorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 116811958
5-(2-bromophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 116812031
N-propyl-5-quinolin-4-yl-1,3-thiazol-2-amine
CID 116812140
2-methyl-4-thiophen-2-ylquinoline
CID 11746306
5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 116811974
N-methyl-5-(2-methylquinolin-4-yl)-1,3,4-thiadiazol-2-amine
CID 82447733
1-[2-(2-methylquinolin-4-yl)-1,3-thiazol-5-yl]ethanamine
CID 79235133
5-(5-chloroquinolin-8-yl)-N-ethyl-1,3-thiazol-2-amine
CID 116811986
N-ethyl-N'-[(2-methylquinolin-4-yl)methyl]ethane-1,2-diamine
CID 113405208
5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 116812059
3-(2-methylquinolin-4-yl)-1,2,4-thiadiazol-5-amine
CID 79235359
2-(2-methylquinolin-4-yl)pyrimidin-4-amine
CID 79234702

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine (CID 116811999) is N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine is CCNc1ncc(-c2cc(C)nc3ccccc23)s1.
What is the InChIKey of N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine?
The InChIKey is USJITOIBYZYIFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3S/c1-3-16-15-17-9-14(19-15)12-8-10(2)18-13-7-5-4-6-11(12)13/h4-9H,3H2,1-2H3,(H,16,17).
What are the key properties of N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine?
N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine has a molecular weight of 269.37 g/mol, XLogP of 4.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(2-methylquinolin-4-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 116811999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).