N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine

C15H15N3S — CID 105172558

IUPACN-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine
SMILESCNC(c1scnc1C)c1cccc2cccnc12
InChIInChI=1S/C15H15N3S/c1-10-15(19-9-18-10)14(16-2)12-7-3-5-11-6-4-8-17-13(11)12/h3-9,14,16H,1-2H3
InChIKeyRHWOTLHWBZPWCG-UHFFFAOYSA-N
MW269.37 g/mol
LogP3.31
Rot. Bonds3

About N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine

N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine (PubChem CID 105172558) has the molecular formula C15H15N3S and a molecular weight of 269.37 g/mol. Its IUPAC name is N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine
PubChem CID105172558
Molecular FormulaC15H15N3S
Molecular Weight269.37 g/mol
Exact Mass269.10
IUPAC NameN-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine
SMILESCNC(c1scnc1C)c1cccc2cccnc12
InChIInChI=1S/C15H15N3S/c1-10-15(19-9-18-10)14(16-2)12-7-3-5-11-6-4-8-17-13(11)12/h3-9,14,16H,1-2H3
InChIKeyRHWOTLHWBZPWCG-UHFFFAOYSA-N
XLogP3.31
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 ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-(2-methyl-3-pyridinyl)-1-quinolin-8-ylmethanamine
CID 105172443
N-methyl-1-(5-methylthiophen-3-yl)-1-quinolin-8-ylmethanamine
CID 105155395
1-(5-bromothiophen-3-yl)-N-methyl-1-quinolin-8-ylmethanamine
CID 105172538
N-methyl-1-(5-methyl-3-pyridinyl)-1-quinolin-8-ylmethanamine
CID 105172541
1-(2,6-difluorophenyl)-N-methyl-1-quinolin-8-ylmethanamine
CID 81229518
N-methyl-1-(2-methyl-4-pyridinyl)-1-quinolin-8-ylmethanamine
CID 106755698
N-methyl-1-(5-methylpyrazin-2-yl)-1-quinolin-8-ylmethanamine
CID 105172471
1-(4-bromophenyl)-N-methyl-1-quinolin-8-ylmethanamine
CID 78917786
1-(2-fluoro-4-methylphenyl)-N-methyl-1-quinolin-8-ylmethanamine
CID 105021150
1-(5-chlorofuran-2-yl)-N-methyl-1-quinolin-8-ylmethanamine
CID 106692805
N-methyl-1-(4-methylsulfanylphenyl)-1-quinolin-8-ylmethanamine
CID 105021332
1-(1-ethylimidazol-2-yl)-N-methyl-1-quinolin-8-ylmethanamine
CID 62875579

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine?
The IUPAC name of N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine (CID 105172558) is N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine.
What is the SMILES notation for N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine?
The canonical SMILES for N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine is CNC(c1scnc1C)c1cccc2cccnc12.
What is the InChIKey of N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine?
The InChIKey is RHWOTLHWBZPWCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3S/c1-10-15(19-9-18-10)14(16-2)12-7-3-5-11-6-4-8-17-13(11)12/h3-9,14,16H,1-2H3.
What are the key properties of N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine?
N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine has a molecular weight of 269.37 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methyl-1,3-thiazol-5-yl)-1-quinolin-8-ylmethanamine is sourced from PubChem (CID 105172558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).