[6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine

C15H19N3S — CID 106906070

IUPAC[6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine
SMILESCC1c2ccsc2CCN1Cc1cccc(CN)n1
InChIInChI=1S/C15H19N3S/c1-11-14-6-8-19-15(14)5-7-18(11)10-13-4-2-3-12(9-16)17-13/h2-4,6,8,11H,5,7,9-10,16H2,1H3
InChIKeyIKDSZSPLVYCLCD-UHFFFAOYSA-N
MW273.41 g/mol
LogP2.72
Rot. Bonds3

About [6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine

[6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine (PubChem CID 106906070) has the molecular formula C15H19N3S and a molecular weight of 273.41 g/mol. Its IUPAC name is [6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine
PubChem CID106906070
Molecular FormulaC15H19N3S
Molecular Weight273.41 g/mol
Exact Mass273.13
IUPAC Name[6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine
SMILESCC1c2ccsc2CCN1Cc1cccc(CN)n1
InChIInChI=1S/C15H19N3S/c1-11-14-6-8-19-15(14)5-7-18(11)10-13-4-2-3-12(9-16)17-13/h2-4,6,8,11H,5,7,9-10,16H2,1H3
InChIKeyIKDSZSPLVYCLCD-UHFFFAOYSA-N
XLogP2.72
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.41
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine?
The IUPAC name of [6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine (CID 106906070) is [6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine.
What is the SMILES notation for [6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine?
The canonical SMILES for [6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine is CC1c2ccsc2CCN1Cc1cccc(CN)n1.
What is the InChIKey of [6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine?
The InChIKey is IKDSZSPLVYCLCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3S/c1-11-14-6-8-19-15(14)5-7-18(11)10-13-4-2-3-12(9-16)17-13/h2-4,6,8,11H,5,7,9-10,16H2,1H3.
What are the key properties of [6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine?
[6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine has a molecular weight of 273.41 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methyl]-2-pyridinyl]methanamine is sourced from PubChem (CID 106906070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).