6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine

C14H11ClN2S — CID 43672406

IUPAC6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine
SMILESClc1cc(NCc2ccsc2)c2ncccc2c1
InChIInChI=1S/C14H11ClN2S/c15-12-6-11-2-1-4-16-14(11)13(7-12)17-8-10-3-5-18-9-10/h1-7,9,17H,8H2
InChIKeyUBFXVUKWAQGNJE-UHFFFAOYSA-N
MW274.78 g/mol
LogP4.56
Rot. Bonds3

About 6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine

6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine (PubChem CID 43672406) has the molecular formula C14H11ClN2S and a molecular weight of 274.78 g/mol. Its IUPAC name is 6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine.

Molecular Properties

Compound Name6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine
PubChem CID43672406
Molecular FormulaC14H11ClN2S
Molecular Weight274.78 g/mol
Exact Mass274.03
IUPAC Name6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine
SMILESClc1cc(NCc2ccsc2)c2ncccc2c1
InChIInChI=1S/C14H11ClN2S/c15-12-6-11-2-1-4-16-14(11)13(7-12)17-8-10-3-5-18-9-10/h1-7,9,17H,8H2
InChIKeyUBFXVUKWAQGNJE-UHFFFAOYSA-N
XLogP4.56
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.78
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-bromo-4-fluorophenyl)methyl]-6-chloroquinolin-8-amine
CID 43672441
N-[(2-bromophenyl)methyl]-6-chloroquinolin-8-amine
CID 43672427
6-chloro-N-[(2-methylphenyl)methyl]quinolin-8-amine
CID 43672377
N-[(5-bromofuran-2-yl)methyl]-6-chloroquinolin-8-amine
CID 43672409
8-N-(thiophen-3-ylmethyl)quinoline-5,8-diamine
CID 55173328
(6-chloroquinolin-8-yl)hydrazine
CID 138505780
6-chloro-N-pentylquinolin-8-amine
CID 43672340
6-chloro-N-hexylquinolin-8-amine
CID 43672362
2-quinolin-8-yl-N-(thiophen-3-ylmethyl)ethanamine
CID 112727575
5-nitro-N-(thiophen-3-ylmethyl)quinolin-8-amine
CID 60964909
2-propan-2-yloxy-N-(thiophen-3-ylmethyl)pyridin-3-amine
CID 61375576
N-(thiophen-3-ylmethyl)isoquinolin-5-amine
CID 43681310

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine?
The IUPAC name of 6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine (CID 43672406) is 6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine.
What is the SMILES notation for 6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine?
The canonical SMILES for 6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine is Clc1cc(NCc2ccsc2)c2ncccc2c1.
What is the InChIKey of 6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine?
The InChIKey is UBFXVUKWAQGNJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2S/c15-12-6-11-2-1-4-16-14(11)13(7-12)17-8-10-3-5-18-9-10/h1-7,9,17H,8H2.
What are the key properties of 6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine?
6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine has a molecular weight of 274.78 g/mol, XLogP of 4.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(thiophen-3-ylmethyl)quinolin-8-amine is sourced from PubChem (CID 43672406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).