(4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine

C16H16N2S — CID 105021067

IUPAC(4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine
SMILESCc1cc(C(N)c2ccc3ncccc3c2)sc1C
InChIInChI=1S/C16H16N2S/c1-10-8-15(19-11(10)2)16(17)13-5-6-14-12(9-13)4-3-7-18-14/h3-9,16H,17H2,1-2H3
InChIKeyWIANNFLDMCSZSY-UHFFFAOYSA-N
MW268.38 g/mol
LogP3.96
Rot. Bonds2

About (4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine

(4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine (PubChem CID 105021067) has the molecular formula C16H16N2S and a molecular weight of 268.38 g/mol. Its IUPAC name is (4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine.

Molecular Properties

Compound Name(4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine
PubChem CID105021067
Molecular FormulaC16H16N2S
Molecular Weight268.38 g/mol
Exact Mass268.10
IUPAC Name(4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine
SMILESCc1cc(C(N)c2ccc3ncccc3c2)sc1C
InChIInChI=1S/C16H16N2S/c1-10-8-15(19-11(10)2)16(17)13-5-6-14-12(9-13)4-3-7-18-14/h3-9,16H,17H2,1-2H3
InChIKeyWIANNFLDMCSZSY-UHFFFAOYSA-N
XLogP3.96
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.38
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-bromo-4-methylthiophen-2-yl)-quinolin-6-ylmethanamine
CID 105021086
(4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanol
CID 115826735
(4,5-dimethylthiophen-2-yl)-quinolin-3-ylmethanamine
CID 115798523
1-(4,5-dimethylthiophen-2-yl)-N-methyl-1-quinolin-6-ylmethanamine
CID 105020999
1-benzothiophen-2-yl(quinolin-6-yl)methanamine
CID 105021010
(6-methyl-3-pyridinyl)-quinolin-6-ylmethanamine
CID 63155973
(4-tert-butylphenyl)-quinolin-6-ylmethanamine
CID 82106268
quinolin-6-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine
CID 106783220
1-(4,5-dimethylthiophen-2-yl)-N-methyl-1-quinolin-7-ylmethanamine
CID 105021513
quinolin-6-yl(1,3-thiazol-2-yl)methanamine
CID 63970380
[(2-methyl-1,3-thiazol-5-yl)-quinolin-6-ylmethyl]hydrazine
CID 114031832
6-(3-quinolin-6-ylbutan-2-yl)quinoline
CID 20658775

Frequently Asked Questions

What is the IUPAC name of (4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine?
The IUPAC name of (4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine (CID 105021067) is (4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine.
What is the SMILES notation for (4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine?
The canonical SMILES for (4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine is Cc1cc(C(N)c2ccc3ncccc3c2)sc1C.
What is the InChIKey of (4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine?
The InChIKey is WIANNFLDMCSZSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2S/c1-10-8-15(19-11(10)2)16(17)13-5-6-14-12(9-13)4-3-7-18-14/h3-9,16H,17H2,1-2H3.
What are the key properties of (4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine?
(4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine has a molecular weight of 268.38 g/mol, XLogP of 3.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4,5-dimethylthiophen-2-yl)-quinolin-6-ylmethanamine is sourced from PubChem (CID 105021067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).