N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine

C14H14N2S2 — CID 65245920

IUPACN-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine
SMILESCc1cc(CNc2nccc3sccc23)sc1C
InChIInChI=1S/C14H14N2S2/c1-9-7-11(18-10(9)2)8-16-14-12-4-6-17-13(12)3-5-15-14/h3-7H,8H2,1-2H3,(H,15,16)
InChIKeySTSJBJTYPMJEQZ-UHFFFAOYSA-N
MW274.41 g/mol
LogP4.59
Rot. Bonds3

About N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine

N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine (PubChem CID 65245920) has the molecular formula C14H14N2S2 and a molecular weight of 274.41 g/mol. Its IUPAC name is N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine
PubChem CID65245920
Molecular FormulaC14H14N2S2
Molecular Weight274.41 g/mol
Exact Mass274.06
IUPAC NameN-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine
SMILESCc1cc(CNc2nccc3sccc23)sc1C
InChIInChI=1S/C14H14N2S2/c1-9-7-11(18-10(9)2)8-16-14-12-4-6-17-13(12)3-5-15-14/h3-7H,8H2,1-2H3,(H,15,16)
InChIKeySTSJBJTYPMJEQZ-UHFFFAOYSA-N
XLogP4.59
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine?
The IUPAC name of N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine (CID 65245920) is N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine?
The canonical SMILES for N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine is Cc1cc(CNc2nccc3sccc23)sc1C.
What is the InChIKey of N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine?
The InChIKey is STSJBJTYPMJEQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2S2/c1-9-7-11(18-10(9)2)8-16-14-12-4-6-17-13(12)3-5-15-14/h3-7H,8H2,1-2H3,(H,15,16).
What are the key properties of N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine?
N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine has a molecular weight of 274.41 g/mol, XLogP of 4.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,5-dimethylthiophen-2-yl)methyl]thieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 65245920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).