3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide

C15H19N3OS — CID 2348592

IUPAC3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
SMILESCc1cc(C)c2c(N)c(C(=O)NC3CCCC3)sc2n1
InChIInChI=1S/C15H19N3OS/c1-8-7-9(2)17-15-11(8)12(16)13(20-15)14(19)18-10-5-3-4-6-10/h7,10H,3-6,16H2,1-2H3,(H,18,19)
InChIKeyMRRXIEJCKOBELW-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.17
Rot. Bonds2

About 3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide

3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide (PubChem CID 2348592) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is 3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
PubChem CID2348592
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC Name3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
SMILESCc1cc(C)c2c(N)c(C(=O)NC3CCCC3)sc2n1
InChIInChI=1S/C15H19N3OS/c1-8-7-9(2)17-15-11(8)12(16)13(20-15)14(19)18-10-5-3-4-6-10/h7,10H,3-6,16H2,1-2H3,(H,18,19)
InChIKeyMRRXIEJCKOBELW-UHFFFAOYSA-N
XLogP3.17
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide (CID 2348592) is 3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide is Cc1cc(C)c2c(N)c(C(=O)NC3CCCC3)sc2n1.
What is the InChIKey of 3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is MRRXIEJCKOBELW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-8-7-9(2)17-15-11(8)12(16)13(20-15)14(19)18-10-5-3-4-6-10/h7,10H,3-6,16H2,1-2H3,(H,18,19).
What are the key properties of 3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide?
3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 289.40 g/mol, XLogP of 3.17, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-cyclopentyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 2348592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).