N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine

C9H10N2S — CID 45117642

IUPACN-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine
SMILESCNCc1cc2cnccc2s1
InChIInChI=1S/C9H10N2S/c1-10-6-8-4-7-5-11-3-2-9(7)12-8/h2-5,10H,6H2,1H3
InChIKeyNRLQDHIBSGMYGV-UHFFFAOYSA-N
MW178.26 g/mol
LogP2.02
Rot. Bonds2

About N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine

N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine (PubChem CID 45117642) has the molecular formula C9H10N2S and a molecular weight of 178.26 g/mol. Its IUPAC name is N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine
PubChem CID45117642
Molecular FormulaC9H10N2S
Molecular Weight178.26 g/mol
Exact Mass178.06
IUPAC NameN-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine
SMILESCNCc1cc2cnccc2s1
InChIInChI=1S/C9H10N2S/c1-10-6-8-4-7-5-11-3-2-9(7)12-8/h2-5,10H,6H2,1H3
InChIKeyNRLQDHIBSGMYGV-UHFFFAOYSA-N
XLogP2.02
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.26
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine?
The IUPAC name of N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine (CID 45117642) is N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine.
What is the SMILES notation for N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine?
The canonical SMILES for N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine is CNCc1cc2cnccc2s1.
What is the InChIKey of N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine?
The InChIKey is NRLQDHIBSGMYGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2S/c1-10-6-8-4-7-5-11-3-2-9(7)12-8/h2-5,10H,6H2,1H3.
What are the key properties of N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine?
N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine has a molecular weight of 178.26 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine is sourced from PubChem (CID 45117642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).