2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine

C13H16N2S — CID 102824819

IUPAC2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine
SMILESCCCNc1ccnc(-c2csc(C)c2)c1
InChIInChI=1S/C13H16N2S/c1-3-5-14-12-4-6-15-13(8-12)11-7-10(2)16-9-11/h4,6-9H,3,5H2,1-2H3,(H,14,15)
InChIKeyXQUIGALUUVRSQN-UHFFFAOYSA-N
MW232.35 g/mol
LogP3.94
Rot. Bonds4

About 2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine

2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine (PubChem CID 102824819) has the molecular formula C13H16N2S and a molecular weight of 232.35 g/mol. Its IUPAC name is 2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine.

Molecular Properties

Compound Name2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine
PubChem CID102824819
Molecular FormulaC13H16N2S
Molecular Weight232.35 g/mol
Exact Mass232.10
IUPAC Name2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine
SMILESCCCNc1ccnc(-c2csc(C)c2)c1
InChIInChI=1S/C13H16N2S/c1-3-5-14-12-4-6-15-13(8-12)11-7-10(2)16-9-11/h4,6-9H,3,5H2,1-2H3,(H,14,15)
InChIKeyXQUIGALUUVRSQN-UHFFFAOYSA-N
XLogP3.94
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(5-methylthiophen-3-yl)-4-pyridinyl]hydrazine
CID 102825297
2-(4-propoxyphenyl)-N-propylpyridin-4-amine
CID 102824748
2-methyl-N-propylpyridin-4-amine
CID 79240818
N-propyl-2-quinolin-3-ylpyridin-4-amine
CID 102824586
4-(5-methylthiophen-3-yl)-N-propyl-6-(trifluoromethyl)pyrimidin-2-amine
CID 114563363
2-(3-propan-2-yloxyphenyl)-N-propylpyridin-4-amine
CID 102824898
4-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-2-N-propylpyridine-2,4-diamine
CID 106041619
2-(2-methylpyrazol-3-yl)-N-propylpyridin-4-amine
CID 102824790
2-(3-bromo-2,4-dimethoxyphenyl)-N-propylpyridin-4-amine
CID 103524034
2-[[2-[4-(2-phosphonoethylamino)-2-pyridinyl]-4-pyridinyl]amino]ethylphosphonic acid
CID 58175914
N-ethyl-4-(5-methylthiophen-3-yl)-1,3-thiazol-2-amine
CID 131181990
N-[[3-(5-methylthiophen-3-yl)furan-2-yl]methyl]propan-1-amine
CID 106887380

Frequently Asked Questions

What is the IUPAC name of 2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine?
The IUPAC name of 2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine (CID 102824819) is 2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine.
What is the SMILES notation for 2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine?
The canonical SMILES for 2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine is CCCNc1ccnc(-c2csc(C)c2)c1.
What is the InChIKey of 2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine?
The InChIKey is XQUIGALUUVRSQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2S/c1-3-5-14-12-4-6-15-13(8-12)11-7-10(2)16-9-11/h4,6-9H,3,5H2,1-2H3,(H,14,15).
What are the key properties of 2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine?
2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine has a molecular weight of 232.35 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methylthiophen-3-yl)-N-propylpyridin-4-amine is sourced from PubChem (CID 102824819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).