N,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine

C14H13N3S — CID 170654991

IUPACN,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine
SMILESCN(C)c1cc(-c2cncs2)c2ccccc2n1
InChIInChI=1S/C14H13N3S/c1-17(2)14-7-11(13-8-15-9-18-13)10-5-3-4-6-12(10)16-14/h3-9H,1-2H3
InChIKeyZPPGUDJWFWTRKV-UHFFFAOYSA-N
MW255.35 g/mol
LogP3.42
Rot. Bonds2

About N,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine

N,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine (PubChem CID 170654991) has the molecular formula C14H13N3S and a molecular weight of 255.35 g/mol. Its IUPAC name is N,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine
PubChem CID170654991
Molecular FormulaC14H13N3S
Molecular Weight255.35 g/mol
Exact Mass255.08
IUPAC NameN,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine
SMILESCN(C)c1cc(-c2cncs2)c2ccccc2n1
InChIInChI=1S/C14H13N3S/c1-17(2)14-7-11(13-8-15-9-18-13)10-5-3-4-6-12(10)16-14/h3-9H,1-2H3
InChIKeyZPPGUDJWFWTRKV-UHFFFAOYSA-N
XLogP3.42
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.35
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(aminomethyl)-N,N-dimethylquinolin-2-amine
CID 56828443
2-N,2-N,4-N-trimethylquinoline-2,4-diamine
CID 14338127
N,N-dimethyl-4,6-diphenylquinolin-2-amine
CID 164669718
N,N,7-trimethyl-4-phenylquinolin-2-amine
CID 164669711
ethane;5-phenyl-1,3-thiazole
CID 143177201
[[2-(dimethylamino)quinolin-4-yl]amino]methylidene-dimethylazanium
CID 6344295
2-methyl-4-thiophen-2-ylquinoline
CID 11746306
5-(2-ethylphenyl)-1,3-thiazole
CID 67816581
4-(1,3-thiazol-5-yl)quinolin-3-amine
CID 155355352
4-[(cyclopropylamino)methyl]-N,N-dimethylquinolin-2-amine
CID 62279811
4-[[2-(dimethylamino)quinolin-4-yl]methyl]benzaldehyde
CID 22282606
2-(dimethylamino)-N-ethylquinoline-4-carboxamide
CID 53016631

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine?
The IUPAC name of N,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine (CID 170654991) is N,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine.
What is the SMILES notation for N,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine?
The canonical SMILES for N,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine is CN(C)c1cc(-c2cncs2)c2ccccc2n1.
What is the InChIKey of N,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine?
The InChIKey is ZPPGUDJWFWTRKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3S/c1-17(2)14-7-11(13-8-15-9-18-13)10-5-3-4-6-12(10)16-14/h3-9H,1-2H3.
What are the key properties of N,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine?
N,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine has a molecular weight of 255.35 g/mol, XLogP of 3.42, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(1,3-thiazol-5-yl)quinolin-2-amine is sourced from PubChem (CID 170654991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).