4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine

C15H14N2S2 — CID 63329419

IUPAC4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine
SMILESCc1ccncc1NCc1cc(-c2cccs2)cs1
InChIInChI=1S/C15H14N2S2/c1-11-4-5-16-9-14(11)17-8-13-7-12(10-19-13)15-3-2-6-18-15/h2-7,9-10,17H,8H2,1H3
InChIKeyZGIGEOHFWZJSEK-UHFFFAOYSA-N
MW286.43 g/mol
LogP4.79
Rot. Bonds4

About 4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine

4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine (PubChem CID 63329419) has the molecular formula C15H14N2S2 and a molecular weight of 286.43 g/mol. Its IUPAC name is 4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine
PubChem CID63329419
Molecular FormulaC15H14N2S2
Molecular Weight286.43 g/mol
Exact Mass286.06
IUPAC Name4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine
SMILESCc1ccncc1NCc1cc(-c2cccs2)cs1
InChIInChI=1S/C15H14N2S2/c1-11-4-5-16-9-14(11)17-8-13-7-12(10-19-13)15-3-2-6-18-15/h2-7,9-10,17H,8H2,1H3
InChIKeyZGIGEOHFWZJSEK-UHFFFAOYSA-N
XLogP4.79
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.43
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine?
The IUPAC name of 4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine (CID 63329419) is 4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine.
What is the SMILES notation for 4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine?
The canonical SMILES for 4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine is Cc1ccncc1NCc1cc(-c2cccs2)cs1.
What is the InChIKey of 4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine?
The InChIKey is ZGIGEOHFWZJSEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2S2/c1-11-4-5-16-9-14(11)17-8-13-7-12(10-19-13)15-3-2-6-18-15/h2-7,9-10,17H,8H2,1H3.
What are the key properties of 4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine?
4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine has a molecular weight of 286.43 g/mol, XLogP of 4.79, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(4-thiophen-2-ylthiophen-2-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 63329419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).