2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine

C16H22N2S — CID 79358299

IUPAC2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine
SMILESCC(NC1C(C)(C)C1(C)C)c1cnc2ccsc2c1
InChIInChI=1S/C16H22N2S/c1-10(18-14-15(2,3)16(14,4)5)11-8-13-12(17-9-11)6-7-19-13/h6-10,14,18H,1-5H3
InChIKeyYDDLYCOPIYNDSG-UHFFFAOYSA-N
MW274.43 g/mol
LogP4.38
Rot. Bonds3

About 2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine

2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine (PubChem CID 79358299) has the molecular formula C16H22N2S and a molecular weight of 274.43 g/mol. Its IUPAC name is 2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine.

Molecular Properties

Compound Name2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine
PubChem CID79358299
Molecular FormulaC16H22N2S
Molecular Weight274.43 g/mol
Exact Mass274.15
IUPAC Name2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine
SMILESCC(NC1C(C)(C)C1(C)C)c1cnc2ccsc2c1
InChIInChI=1S/C16H22N2S/c1-10(18-14-15(2,3)16(14,4)5)11-8-13-12(17-9-11)6-7-19-13/h6-10,14,18H,1-5H3
InChIKeyYDDLYCOPIYNDSG-UHFFFAOYSA-N
XLogP4.38
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine?
The IUPAC name of 2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine (CID 79358299) is 2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine.
What is the SMILES notation for 2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine?
The canonical SMILES for 2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine is CC(NC1C(C)(C)C1(C)C)c1cnc2ccsc2c1.
What is the InChIKey of 2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine?
The InChIKey is YDDLYCOPIYNDSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2S/c1-10(18-14-15(2,3)16(14,4)5)11-8-13-12(17-9-11)6-7-19-13/h6-10,14,18H,1-5H3.
What are the key properties of 2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine?
2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine has a molecular weight of 274.43 g/mol, XLogP of 4.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetramethyl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)cyclopropan-1-amine is sourced from PubChem (CID 79358299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).