N-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine

C15H14N2S — CID 81224978

IUPACN-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine
SMILESCNCc1csc(-c2cccc3ncccc23)c1
InChIInChI=1S/C15H14N2S/c1-16-9-11-8-15(18-10-11)13-4-2-6-14-12(13)5-3-7-17-14/h2-8,10,16H,9H2,1H3
InChIKeyNSMMNVMKFNMERK-UHFFFAOYSA-N
MW254.36 g/mol
LogP3.68
Rot. Bonds3

About N-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine

N-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine (PubChem CID 81224978) has the molecular formula C15H14N2S and a molecular weight of 254.36 g/mol. Its IUPAC name is N-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine
PubChem CID81224978
Molecular FormulaC15H14N2S
Molecular Weight254.36 g/mol
Exact Mass254.09
IUPAC NameN-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine
SMILESCNCc1csc(-c2cccc3ncccc23)c1
InChIInChI=1S/C15H14N2S/c1-16-9-11-8-15(18-10-11)13-4-2-6-14-12(13)5-3-7-17-14/h2-8,10,16H,9H2,1H3
InChIKeyNSMMNVMKFNMERK-UHFFFAOYSA-N
XLogP3.68
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.36
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-Thienyl)quinoline
CID 251365
N-(quinolin-8-yl)thiophene-2-sulfonamide
CID 830459
3-(3-Thienyl)quinoline
CID 10242258
Propyl-(6,7,8,9-tetrahydro-3H-benzo[e]indol-8-yl)-(2-thiophen-2-yl-ethyl)-amine
CID 10382523
3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indole
CID 5329361
dimethyl(2-{3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indol-1-yl}ethyl)amine
CID 5329362
dimethyl(3-{3-[5-(thiophen-3-yl)pyridin-3-yl]-1H-indol-1-yl}propyl)amine
CID 5329367
3-(5-Thien-3-ylpyridin-3-yl)-1Hindole 3h
CID 5329368
5,7-Dimethyl-3-thiophen-3-yl-quinoline
CID 10060170
2-(5-Thiophen-2-yl-1H-indol-3-yl)-ethylamine
CID 10198700
7-Fluoro-3-thiophen-3-yl-quinoline
CID 10398928
5-Fluoro-3-thiophen-3-yl-quinoline
CID 10421346

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine?
The IUPAC name of N-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine (CID 81224978) is N-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine.
What is the SMILES notation for N-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine?
The canonical SMILES for N-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine is CNCc1csc(-c2cccc3ncccc23)c1.
What is the InChIKey of N-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine?
The InChIKey is NSMMNVMKFNMERK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2S/c1-16-9-11-8-15(18-10-11)13-4-2-6-14-12(13)5-3-7-17-14/h2-8,10,16H,9H2,1H3.
What are the key properties of N-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine?
N-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine has a molecular weight of 254.36 g/mol, XLogP of 3.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-quinolin-5-ylthiophen-3-yl)methanamine is sourced from PubChem (CID 81224978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).