5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine

C12H14N2S2 — CID 43302216

IUPAC5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine
SMILESCCc1ccc(CSc2ccc(N)nc2)s1
InChIInChI=1S/C12H14N2S2/c1-2-9-3-4-11(16-9)8-15-10-5-6-12(13)14-7-10/h3-7H,2,8H2,1H3,(H2,13,14)
InChIKeyUSCXWRHOHAWXIY-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.58
Rot. Bonds4

About 5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine

5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine (PubChem CID 43302216) has the molecular formula C12H14N2S2 and a molecular weight of 250.39 g/mol. Its IUPAC name is 5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine.

Molecular Properties

Compound Name5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine
PubChem CID43302216
Molecular FormulaC12H14N2S2
Molecular Weight250.39 g/mol
Exact Mass250.06
IUPAC Name5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine
SMILESCCc1ccc(CSc2ccc(N)nc2)s1
InChIInChI=1S/C12H14N2S2/c1-2-9-3-4-11(16-9)8-15-10-5-6-12(13)14-7-10/h3-7H,2,8H2,1H3,(H2,13,14)
InChIKeyUSCXWRHOHAWXIY-UHFFFAOYSA-N
XLogP3.58
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[(5-ethylthiophen-2-yl)methylsulfanyl]-1,3-thiazol-2-amine
CID 24706770
5-[(5-methyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyridin-2-amine
CID 43302148
5-(ethoxymethylsulfanyl)pyridin-2-amine
CID 65369754
5-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]pyridin-2-amine
CID 43302152
5-[(1-ethylimidazol-2-yl)methylsulfanyl]pyridin-2-amine
CID 62735685
5-[(E)-but-2-enyl]sulfanylpyridin-2-amine
CID 43302260
2-[4-[(5-ethylthiophen-2-yl)methylsulfanyl]phenyl]acetic acid
CID 64926971
5-[3-(methylamino)propylsulfanyl]pyridin-2-amine
CID 106318328
5-(2-propoxyethylsulfanyl)pyridin-2-amine
CID 106453324
2,5-diethylthiophene
CID 521294
5-[(2,5-dimethoxyphenyl)methylsulfanyl]pyridin-2-amine
CID 43301902
5-[(2-fluorophenyl)methylsulfanyl]pyridin-2-amine
CID 43302227

Frequently Asked Questions

What is the IUPAC name of 5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine?
The IUPAC name of 5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine (CID 43302216) is 5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine.
What is the SMILES notation for 5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine?
The canonical SMILES for 5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine is CCc1ccc(CSc2ccc(N)nc2)s1.
What is the InChIKey of 5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine?
The InChIKey is USCXWRHOHAWXIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2S2/c1-2-9-3-4-11(16-9)8-15-10-5-6-12(13)14-7-10/h3-7H,2,8H2,1H3,(H2,13,14).
What are the key properties of 5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine?
5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine has a molecular weight of 250.39 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-ethylthiophen-2-yl)methylsulfanyl]pyridin-2-amine is sourced from PubChem (CID 43302216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).