6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine

C12H14N2S2 — CID 115929489

IUPAC6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine
SMILESCSc1ccc(NC(C)c2cccs2)cn1
InChIInChI=1S/C12H14N2S2/c1-9(11-4-3-7-16-11)14-10-5-6-12(15-2)13-8-10/h3-9,14H,1-2H3
InChIKeyIBOSOXZBNAPHIP-UHFFFAOYSA-N
MW250.39 g/mol
LogP4.04
Rot. Bonds4

About 6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine

6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine (PubChem CID 115929489) has the molecular formula C12H14N2S2 and a molecular weight of 250.39 g/mol. Its IUPAC name is 6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine.

Molecular Properties

Compound Name6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine
PubChem CID115929489
Molecular FormulaC12H14N2S2
Molecular Weight250.39 g/mol
Exact Mass250.06
IUPAC Name6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine
SMILESCSc1ccc(NC(C)c2cccs2)cn1
InChIInChI=1S/C12H14N2S2/c1-9(11-4-3-7-16-11)14-10-5-6-12(15-2)13-8-10/h3-9,14H,1-2H3
InChIKeyIBOSOXZBNAPHIP-UHFFFAOYSA-N
XLogP4.04
TPSA24.92 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 ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methylsulfanyl-N-propan-2-ylpyridin-3-amine
CID 115929480
6-nitro-N-[(1R)-1-thiophen-2-ylethyl]pyridin-3-amine
CID 94392449
6-(2-methoxyethoxy)-N-(1-thiophen-2-ylethyl)pyridin-3-amine
CID 43688399
4-N-(1-thiophen-2-ylethyl)benzene-1,4-diamine
CID 43534384
3,5-dimethoxy-N-(1-thiophen-2-ylethyl)aniline
CID 43192817
N-(1-thiophen-2-ylethyl)pyrimidin-2-amine
CID 43397770
N-(dicyclopropylmethyl)-6-methylsulfanylpyridin-3-amine
CID 115929475
N-(1-thiophen-2-ylethyl)quinoxalin-2-amine
CID 47142874
4-methyl-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine
CID 62958907
2-(4-methylpiperazin-1-yl)-N-(6-methylsulfanyl-3-pyridinyl)propanamide
CID 75371060
4-(4-methyl-1,2,4-triazol-3-yl)-N-(1-thiophen-2-ylethyl)aniline
CID 43686655
4-(2-methyl-1,3-oxazol-4-yl)-N-(1-thiophen-2-ylethyl)aniline
CID 43704849

Frequently Asked Questions

What is the IUPAC name of 6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine?
The IUPAC name of 6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine (CID 115929489) is 6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine.
What is the SMILES notation for 6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine?
The canonical SMILES for 6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine is CSc1ccc(NC(C)c2cccs2)cn1.
What is the InChIKey of 6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine?
The InChIKey is IBOSOXZBNAPHIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2S2/c1-9(11-4-3-7-16-11)14-10-5-6-12(15-2)13-8-10/h3-9,14H,1-2H3.
What are the key properties of 6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine?
6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine has a molecular weight of 250.39 g/mol, XLogP of 4.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine is sourced from PubChem (CID 115929489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).