1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine

C11H12N2S — CID 4719994

IUPAC1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine
SMILESc1ccc(CNCc2cccs2)nc1
InChIInChI=1S/C11H12N2S/c1-2-6-13-10(4-1)8-12-9-11-5-3-7-14-11/h1-7,12H,8-9H2
InChIKeyHQQIBEIYAHFULM-UHFFFAOYSA-N
MW204.30 g/mol
LogP2.43
Rot. Bonds4

About 1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine

1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine (PubChem CID 4719994) has the molecular formula C11H12N2S and a molecular weight of 204.30 g/mol. Its IUPAC name is 1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine
PubChem CID4719994
Molecular FormulaC11H12N2S
Molecular Weight204.30 g/mol
Exact Mass204.07
IUPAC Name1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine
SMILESc1ccc(CNCc2cccs2)nc1
InChIInChI=1S/C11H12N2S/c1-2-6-13-10(4-1)8-12-9-11-5-3-7-14-11/h1-7,12H,8-9H2
InChIKeyHQQIBEIYAHFULM-UHFFFAOYSA-N
XLogP2.43
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.30
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 595254
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CID 251141
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CID 595145
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CID 2760514
CID 2760514
CID 11063448
CID 11063448
CID 11206290
CID 11206290
CID 11321674
CID 11321674
CID 761521
CID 761521
CID 2801704
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CID 964916
CID 964916

Frequently Asked Questions

What is the IUPAC name of 1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine?
The IUPAC name of 1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine (CID 4719994) is 1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine.
What is the SMILES notation for 1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine?
The canonical SMILES for 1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine is c1ccc(CNCc2cccs2)nc1.
What is the InChIKey of 1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine?
The InChIKey is HQQIBEIYAHFULM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2S/c1-2-6-13-10(4-1)8-12-9-11-5-3-7-14-11/h1-7,12H,8-9H2.
What are the key properties of 1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine?
1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine has a molecular weight of 204.30 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-2-yl-N-(thiophen-2-ylmethyl)methanamine is sourced from PubChem (CID 4719994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).