6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine

C16H15N3OS — CID 3141524

IUPAC6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine
SMILESCOc1ccc2nc(C)cc(NN=Cc3cccs3)c2c1
InChIInChI=1S/C16H15N3OS/c1-11-8-16(19-17-10-13-4-3-7-21-13)14-9-12(20-2)5-6-15(14)18-11/h3-10H,1-2H3,(H,18,19)
InChIKeyDQGUJKABKHECNV-UHFFFAOYSA-N
MW297.38 g/mol
LogP4.06
Rot. Bonds4

About 6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine

6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine (PubChem CID 3141524) has the molecular formula C16H15N3OS and a molecular weight of 297.38 g/mol. Its IUPAC name is 6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine.

Molecular Properties

Compound Name6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine
PubChem CID3141524
Molecular FormulaC16H15N3OS
Molecular Weight297.38 g/mol
Exact Mass297.09
IUPAC Name6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine
SMILESCOc1ccc2nc(C)cc(NN=Cc3cccs3)c2c1
InChIInChI=1S/C16H15N3OS/c1-11-8-16(19-17-10-13-4-3-7-21-13)14-9-12(20-2)5-6-15(14)18-11/h3-10H,1-2H3,(H,18,19)
InChIKeyDQGUJKABKHECNV-UHFFFAOYSA-N
XLogP4.06
TPSA46.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(6-methoxy-4-methylquinolin-2-yl)-N'-(thiophen-3-ylmethyl)propane-1,3-diamine
CID 9927967
6-Methoxy-3-thiophen-3-yl-quinoline
CID 10083051
3-(2,7-Dimethoxyacridin-9-ylthio)propan-1-amine
CID 53390843
((1E)-2-phenyl-1-azavinyl)(6-methoxy-2-methyl(4-quinolyl))amine
CID 19577710
6-methoxy-2-methyl-N-(pyridin-4-ylmethylideneamino)quinolin-4-amine
CID 44537047
CID 3141521
CID 3141521
6-Methoxy-2-methyl-4-(2-(pyridin-3-ylmethylene)hydrazinyl)quinoline
CID 9555351
N-[(E)-(2-methoxyphenyl)methylideneamino]-2-(2-methylquinolin-4-yl)sulfanylacetamide
CID 9564523
(6-Methoxy-2-methyl-quinolin-4-ylsulfanyl)-acetic acid benzylidene-hydrazide
CID 9564537
2-[(6-methoxy-2-methyl-4-quinolyl)thio]-N-(1-naphthylmethyleneamino)acetamide
CID 9564541
6-methoxy-N-[(E)-(4-methoxyphenyl)methyleneamino]-2-methyl-quinolin-4-amine
CID 9574191
N-[(E)-(4-fluorophenyl)methylideneamino]-6-methoxy-2-methylquinolin-4-amine
CID 9594974

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine?
The IUPAC name of 6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine (CID 3141524) is 6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine.
What is the SMILES notation for 6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine?
The canonical SMILES for 6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine is COc1ccc2nc(C)cc(NN=Cc3cccs3)c2c1.
What is the InChIKey of 6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine?
The InChIKey is DQGUJKABKHECNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3OS/c1-11-8-16(19-17-10-13-4-3-7-21-13)14-9-12(20-2)5-6-15(14)18-11/h3-10H,1-2H3,(H,18,19).
What are the key properties of 6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine?
6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine has a molecular weight of 297.38 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-methyl-N-(thiophen-2-ylmethylideneamino)quinolin-4-amine is sourced from PubChem (CID 3141524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).