1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine

C16H16N2S — CID 62634602

IUPAC1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine
SMILESCCC(N)c1ccc(-c2ccc3ncccc3c2)s1
InChIInChI=1S/C16H16N2S/c1-2-13(17)16-8-7-15(19-16)12-5-6-14-11(10-12)4-3-9-18-14/h3-10,13H,2,17H2,1H3
InChIKeyWRPFMTOZAYEXPF-UHFFFAOYSA-N
MW268.38 g/mol
LogP4.37
Rot. Bonds3

About 1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine

1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine (PubChem CID 62634602) has the molecular formula C16H16N2S and a molecular weight of 268.38 g/mol. Its IUPAC name is 1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine.

Molecular Properties

Compound Name1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine
PubChem CID62634602
Molecular FormulaC16H16N2S
Molecular Weight268.38 g/mol
Exact Mass268.10
IUPAC Name1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine
SMILESCCC(N)c1ccc(-c2ccc3ncccc3c2)s1
InChIInChI=1S/C16H16N2S/c1-2-13(17)16-8-7-15(19-16)12-5-6-14-11(10-12)4-3-9-18-14/h3-10,13H,2,17H2,1H3
InChIKeyWRPFMTOZAYEXPF-UHFFFAOYSA-N
XLogP4.37
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.38
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine
CID 62635651
N-methyl-1-(5-quinolin-6-ylthiophen-2-yl)methanamine
CID 62635117
N-[(5-quinolin-6-ylthiophen-2-yl)methyl]propan-2-amine
CID 62635471
1-[5-(3-chloro-4-methylphenyl)thiophen-2-yl]propan-1-amine
CID 43154192
3-methyl-1-(4-quinolin-6-ylphenyl)butan-2-amine
CID 82541687
1-quinolin-6-ylbutan-1-amine
CID 63095616
(1S)-2-methyl-1-(3-quinolin-6-yl-1,2,4-oxadiazol-5-yl)butan-1-amine
CID 104900102
2-propyl-4-quinolin-6-yl-1,3-thiazol-5-amine
CID 63967638
2-(4-methylphenyl)-1-quinolin-6-ylethanamine
CID 63097383
N-[1-(2-quinolin-6-yl-1,3-thiazol-5-yl)ethyl]propan-1-amine
CID 63095112
5-quinolin-6-yl-6-(triazol-2-yl)pyrazin-2-amine
CID 137431097
(1R)-1-(1,5-naphthyridin-2-yl)propan-1-amine
CID 130615204

Frequently Asked Questions

What is the IUPAC name of 1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine?
The IUPAC name of 1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine (CID 62634602) is 1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine.
What is the SMILES notation for 1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine?
The canonical SMILES for 1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine is CCC(N)c1ccc(-c2ccc3ncccc3c2)s1.
What is the InChIKey of 1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine?
The InChIKey is WRPFMTOZAYEXPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2S/c1-2-13(17)16-8-7-15(19-16)12-5-6-14-11(10-12)4-3-9-18-14/h3-10,13H,2,17H2,1H3.
What are the key properties of 1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine?
1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine has a molecular weight of 268.38 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-quinolin-6-ylthiophen-2-yl)propan-1-amine is sourced from PubChem (CID 62634602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).