N-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine

C17H18N2S — CID 105020873

IUPACN-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine
SMILESCNC(c1ccc2nc(C)ccc2c1)c1sccc1C
InChIInChI=1S/C17H18N2S/c1-11-8-9-20-17(11)16(18-3)14-6-7-15-13(10-14)5-4-12(2)19-15/h4-10,16,18H,1-3H3
InChIKeyOOAWPNMIXFJBSK-UHFFFAOYSA-N
MW282.41 g/mol
LogP4.22
Rot. Bonds3

About N-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine

N-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine (PubChem CID 105020873) has the molecular formula C17H18N2S and a molecular weight of 282.41 g/mol. Its IUPAC name is N-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine
PubChem CID105020873
Molecular FormulaC17H18N2S
Molecular Weight282.41 g/mol
Exact Mass282.12
IUPAC NameN-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine
SMILESCNC(c1ccc2nc(C)ccc2c1)c1sccc1C
InChIInChI=1S/C17H18N2S/c1-11-8-9-20-17(11)16(18-3)14-6-7-15-13(10-14)5-4-12(2)19-15/h4-10,16,18H,1-3H3
InChIKeyOOAWPNMIXFJBSK-UHFFFAOYSA-N
XLogP4.22
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-chloro-4-methylthiophen-2-yl)-N-methyl-1-(2-methylquinolin-6-yl)methanamine
CID 103406957
1-(4-ethylthiadiazol-5-yl)-N-methyl-1-(2-methylquinolin-6-yl)methanamine
CID 105172229
N-methyl-1-(2-methylquinolin-6-yl)-1-pyridin-4-ylmethanamine
CID 81220925
1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-methyl-1-(2-methylquinolin-6-yl)methanamine
CID 105379120
N-methyl-1-(2-methylquinolin-6-yl)-1-pyridazin-4-ylmethanamine
CID 105172295
1-(4-tert-butylphenyl)-N-methyl-1-(3-methylthiophen-2-yl)methanamine
CID 43484390
3-[methylamino-(3-methylthiophen-2-yl)methyl]aniline
CID 116951934
N-[(2-methylquinolin-6-yl)-(1,3-thiazol-2-yl)methyl]propan-1-amine
CID 105379123
N-[(2-methylquinolin-6-yl)-thiophen-3-ylmethyl]ethanamine
CID 81220693
N-methyl-1-(3-methylthiophen-2-yl)-1-[4-(trifluoromethyl)phenyl]methanamine
CID 55006914
N-[(2-methylquinolin-6-yl)-(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine
CID 105172283
[(2-methylquinolin-6-yl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
CID 105327190

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine?
The IUPAC name of N-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine (CID 105020873) is N-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine is CNC(c1ccc2nc(C)ccc2c1)c1sccc1C.
What is the InChIKey of N-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine?
The InChIKey is OOAWPNMIXFJBSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2S/c1-11-8-9-20-17(11)16(18-3)14-6-7-15-13(10-14)5-4-12(2)19-15/h4-10,16,18H,1-3H3.
What are the key properties of N-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine?
N-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine has a molecular weight of 282.41 g/mol, XLogP of 4.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylquinolin-6-yl)-1-(3-methylthiophen-2-yl)methanamine is sourced from PubChem (CID 105020873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).