N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine

C16H21N3S — CID 106641172

IUPACN-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine
SMILESc1cc2sccc2c(N(CC2CCCCN2)C2CC2)n1
InChIInChI=1S/C16H21N3S/c1-2-8-17-12(3-1)11-19(13-4-5-13)16-14-7-10-20-15(14)6-9-18-16/h6-7,9-10,12-13,17H,1-5,8,11H2
InChIKeyRZPJLPIQAZXZLG-UHFFFAOYSA-N
MW287.43 g/mol
LogP3.41
Rot. Bonds4

About N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine

N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine (PubChem CID 106641172) has the molecular formula C16H21N3S and a molecular weight of 287.43 g/mol. Its IUPAC name is N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine
PubChem CID106641172
Molecular FormulaC16H21N3S
Molecular Weight287.43 g/mol
Exact Mass287.15
IUPAC NameN-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine
SMILESc1cc2sccc2c(N(CC2CCCCN2)C2CC2)n1
InChIInChI=1S/C16H21N3S/c1-2-8-17-12(3-1)11-19(13-4-5-13)16-14-7-10-20-15(14)6-9-18-16/h6-7,9-10,12-13,17H,1-5,8,11H2
InChIKeyRZPJLPIQAZXZLG-UHFFFAOYSA-N
XLogP3.41
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.43
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine?
The IUPAC name of N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine (CID 106641172) is N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine?
The canonical SMILES for N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine is c1cc2sccc2c(N(CC2CCCCN2)C2CC2)n1.
What is the InChIKey of N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine?
The InChIKey is RZPJLPIQAZXZLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3S/c1-2-8-17-12(3-1)11-19(13-4-5-13)16-14-7-10-20-15(14)6-9-18-16/h6-7,9-10,12-13,17H,1-5,8,11H2.
What are the key properties of N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine?
N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine has a molecular weight of 287.43 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(piperidin-2-ylmethyl)thieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 106641172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).