2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine

C10H14N4S — CID 83838938

IUPAC2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine
SMILESCC(CN)N(C)c1ccc2cnsc2n1
InChIInChI=1S/C10H14N4S/c1-7(5-11)14(2)9-4-3-8-6-12-15-10(8)13-9/h3-4,6-7H,5,11H2,1-2H3
InChIKeyBGDDESBWDHCNHP-UHFFFAOYSA-N
MW222.32 g/mol
LogP1.47
Rot. Bonds3

About 2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine

2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine (PubChem CID 83838938) has the molecular formula C10H14N4S and a molecular weight of 222.32 g/mol. Its IUPAC name is 2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine.

Molecular Properties

Compound Name2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine
PubChem CID83838938
Molecular FormulaC10H14N4S
Molecular Weight222.32 g/mol
Exact Mass222.09
IUPAC Name2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine
SMILESCC(CN)N(C)c1ccc2cnsc2n1
InChIInChI=1S/C10H14N4S/c1-7(5-11)14(2)9-4-3-8-6-12-15-10(8)13-9/h3-4,6-7H,5,11H2,1-2H3
InChIKeyBGDDESBWDHCNHP-UHFFFAOYSA-N
XLogP1.47
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.32
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine?
The IUPAC name of 2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine (CID 83838938) is 2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine.
What is the SMILES notation for 2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine?
The canonical SMILES for 2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine is CC(CN)N(C)c1ccc2cnsc2n1.
What is the InChIKey of 2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine?
The InChIKey is BGDDESBWDHCNHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4S/c1-7(5-11)14(2)9-4-3-8-6-12-15-10(8)13-9/h3-4,6-7H,5,11H2,1-2H3.
What are the key properties of 2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine?
2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine has a molecular weight of 222.32 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-2-N-([1,2]thiazolo[5,4-b]pyridin-6-yl)propane-1,2-diamine is sourced from PubChem (CID 83838938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).