N,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine

C9H14N2S2 — CID 11117414

IUPACN,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine
SMILESCSc1cc(N(C)C)cc(SC)n1
InChIInChI=1S/C9H14N2S2/c1-11(2)7-5-8(12-3)10-9(6-7)13-4/h5-6H,1-4H3
InChIKeyJYHRYFQSEQOUBK-UHFFFAOYSA-N
MW214.36 g/mol
LogP2.59
Rot. Bonds3

About N,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine

N,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine (PubChem CID 11117414) has the molecular formula C9H14N2S2 and a molecular weight of 214.36 g/mol. Its IUPAC name is N,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine
PubChem CID11117414
Molecular FormulaC9H14N2S2
Molecular Weight214.36 g/mol
Exact Mass214.06
IUPAC NameN,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine
SMILESCSc1cc(N(C)C)cc(SC)n1
InChIInChI=1S/C9H14N2S2/c1-11(2)7-5-8(12-3)10-9(6-7)13-4/h5-6H,1-4H3
InChIKeyJYHRYFQSEQOUBK-UHFFFAOYSA-N
XLogP2.59
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.36
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine?
The IUPAC name of N,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine (CID 11117414) is N,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine.
What is the SMILES notation for N,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine?
The canonical SMILES for N,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine is CSc1cc(N(C)C)cc(SC)n1.
What is the InChIKey of N,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine?
The InChIKey is JYHRYFQSEQOUBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2S2/c1-11(2)7-5-8(12-3)10-9(6-7)13-4/h5-6H,1-4H3.
What are the key properties of N,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine?
N,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine has a molecular weight of 214.36 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2,6-bis(methylsulfanyl)pyridin-4-amine is sourced from PubChem (CID 11117414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).