N-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine

C15H15N3S — CID 102841956

IUPACN-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine
SMILESCNC(c1ccsc1C)c1cccc2nccnc12
InChIInChI=1S/C15H15N3S/c1-10-11(6-9-19-10)14(16-2)12-4-3-5-13-15(12)18-8-7-17-13/h3-9,14,16H,1-2H3
InChIKeyQQACLNPBWCCKLP-UHFFFAOYSA-N
MW269.37 g/mol
LogP3.31
Rot. Bonds3

About N-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine

N-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine (PubChem CID 102841956) has the molecular formula C15H15N3S and a molecular weight of 269.37 g/mol. Its IUPAC name is N-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine
PubChem CID102841956
Molecular FormulaC15H15N3S
Molecular Weight269.37 g/mol
Exact Mass269.10
IUPAC NameN-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine
SMILESCNC(c1ccsc1C)c1cccc2nccnc12
InChIInChI=1S/C15H15N3S/c1-10-11(6-9-19-10)14(16-2)12-4-3-5-13-15(12)18-8-7-17-13/h3-9,14,16H,1-2H3
InChIKeyQQACLNPBWCCKLP-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-phenyl-1-quinoxalin-5-ylmethanamine
CID 105084067
1-(2,4-difluorophenyl)-N-methyl-1-quinoxalin-5-ylmethanamine
CID 105143729
(1S)-N-methyl-1-quinoxalin-5-ylethanamine
CID 131196182
1-cyclopropyl-N-methyl-1-quinoxalin-5-ylmethanamine
CID 105157235
N-methyl-1-(2-methylthiophen-3-yl)-1-quinolin-2-ylmethanamine
CID 102832467
N-[(3-bromothiophen-2-yl)-quinoxalin-5-ylmethyl]ethanamine
CID 105172958
N-methyl-1-(2-methylpyrazol-3-yl)-1-(2-methylthiophen-3-yl)methanamine
CID 102841118
1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinoxalin-5-ylmethanamine
CID 105102445
N-[(3-chlorothiophen-2-yl)-quinoxalin-5-ylmethyl]propan-1-amine
CID 107361665
N-methyl-1-(2-methyl-3-pyridinyl)-1-quinolin-8-ylmethanamine
CID 105172443
[(4-methylphenyl)-quinoxalin-5-ylmethyl]hydrazine
CID 105285393
N-methyl-1-(3-methylthiophen-2-yl)-1-quinolin-5-ylmethanamine
CID 115604972

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine?
The IUPAC name of N-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine (CID 102841956) is N-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine.
What is the SMILES notation for N-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine?
The canonical SMILES for N-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine is CNC(c1ccsc1C)c1cccc2nccnc12.
What is the InChIKey of N-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine?
The InChIKey is QQACLNPBWCCKLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3S/c1-10-11(6-9-19-10)14(16-2)12-4-3-5-13-15(12)18-8-7-17-13/h3-9,14,16H,1-2H3.
What are the key properties of N-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine?
N-methyl-1-(2-methylthiophen-3-yl)-1-quinoxalin-5-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-(2-methylthiophen-3-yl)-1-quinoxalin-5-ylmethanamine is sourced from PubChem (CID 102841956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).