N-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine

C11H14N2S — CID 115765554

IUPACN-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine
SMILESCC(C)NCc1cnc2ccsc2c1
InChIInChI=1S/C11H14N2S/c1-8(2)12-6-9-5-11-10(13-7-9)3-4-14-11/h3-5,7-8,12H,6H2,1-2H3
InChIKeyDBAGTHXZFYRTMJ-UHFFFAOYSA-N
MW206.31 g/mol
LogP2.79
Rot. Bonds3

About N-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine

N-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine (PubChem CID 115765554) has the molecular formula C11H14N2S and a molecular weight of 206.31 g/mol. Its IUPAC name is N-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine.

Molecular Properties

Compound NameN-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine
PubChem CID115765554
Molecular FormulaC11H14N2S
Molecular Weight206.31 g/mol
Exact Mass206.09
IUPAC NameN-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine
SMILESCC(C)NCc1cnc2ccsc2c1
InChIInChI=1S/C11H14N2S/c1-8(2)12-6-9-5-11-10(13-7-9)3-4-14-11/h3-5,7-8,12H,6H2,1-2H3
InChIKeyDBAGTHXZFYRTMJ-UHFFFAOYSA-N
XLogP2.79
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine?
The IUPAC name of N-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine (CID 115765554) is N-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine.
What is the SMILES notation for N-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine?
The canonical SMILES for N-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine is CC(C)NCc1cnc2ccsc2c1.
What is the InChIKey of N-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine?
The InChIKey is DBAGTHXZFYRTMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2S/c1-8(2)12-6-9-5-11-10(13-7-9)3-4-14-11/h3-5,7-8,12H,6H2,1-2H3.
What are the key properties of N-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine?
N-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine has a molecular weight of 206.31 g/mol, XLogP of 2.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thieno[3,2-b]pyridin-6-ylmethyl)propan-2-amine is sourced from PubChem (CID 115765554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).