4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine

C14H12ClN3S — CID 82449132

IUPAC4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine
SMILESCNc1nc(-c2cc(C)nc3ccc(Cl)cc23)cs1
InChIInChI=1S/C14H12ClN3S/c1-8-5-10(13-7-19-14(16-2)18-13)11-6-9(15)3-4-12(11)17-8/h3-7H,1-2H3,(H,16,18)
InChIKeyCHALIVGWNNZJEA-UHFFFAOYSA-N
MW289.79 g/mol
LogP4.36
Rot. Bonds2

About 4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine

4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine (PubChem CID 82449132) has the molecular formula C14H12ClN3S and a molecular weight of 289.79 g/mol. Its IUPAC name is 4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine
PubChem CID82449132
Molecular FormulaC14H12ClN3S
Molecular Weight289.79 g/mol
Exact Mass289.04
IUPAC Name4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine
SMILESCNc1nc(-c2cc(C)nc3ccc(Cl)cc23)cs1
InChIInChI=1S/C14H12ClN3S/c1-8-5-10(13-7-19-14(16-2)18-13)11-6-9(15)3-4-12(11)17-8/h3-7H,1-2H3,(H,16,18)
InChIKeyCHALIVGWNNZJEA-UHFFFAOYSA-N
XLogP4.36
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.79
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-bromo-4-chlorophenyl)-N-methyl-1,3-thiazol-2-amine
CID 86657697
N-methyl-4-(2,7,8-trimethylquinolin-4-yl)-1,3-thiazol-2-amine
CID 82448433
N-methyl-4-(2-propan-2-ylquinolin-4-yl)-1,3-thiazol-2-amine
CID 82447779
N-methyl-4-(4-methylnaphthalen-1-yl)-1,3-thiazol-2-amine
CID 83801577
N-methyl-4-(3-methylazulen-1-yl)-1,3-thiazol-2-amine
CID 11436742
4-(2,4-dimethylphenyl)-N-methyl-1,3-thiazol-2-amine
CID 17465165
1-(6-chloro-2-methylquinolin-4-yl)-N-methylmethanamine
CID 82449106
3-(6-chloro-2-methylquinolin-4-yl)-4-methyl-1H-1,2,4-triazole-5-thione
CID 82449126
4-[4-chloro-2-(6-methoxy-3-pyridinyl)phenyl]-N-methyl-1,3-thiazol-2-amine
CID 87311082
2,6-dimethyl-4-[2-(methylamino)-1,3-thiazol-4-yl]pyridazin-3-one
CID 82442682
6-chloro-N-methyl-1,3-benzothiazol-2-amine
CID 10774358
N-[(6-chloro-2-methylquinolin-4-yl)methyl]ethanamine
CID 82449107

Frequently Asked Questions

What is the IUPAC name of 4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine?
The IUPAC name of 4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine (CID 82449132) is 4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine is CNc1nc(-c2cc(C)nc3ccc(Cl)cc23)cs1.
What is the InChIKey of 4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine?
The InChIKey is CHALIVGWNNZJEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3S/c1-8-5-10(13-7-19-14(16-2)18-13)11-6-9(15)3-4-12(11)17-8/h3-7H,1-2H3,(H,16,18).
What are the key properties of 4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine?
4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine has a molecular weight of 289.79 g/mol, XLogP of 4.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-chloro-2-methylquinolin-4-yl)-N-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 82449132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).