N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide

C15H22N2OS — CID 53014818

IUPACN-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide
SMILESCN1CCCc2cc(C(=O)NC3CCCCC3)sc21
InChIInChI=1S/C15H22N2OS/c1-17-9-5-6-11-10-13(19-15(11)17)14(18)16-12-7-3-2-4-8-12/h10,12H,2-9H2,1H3,(H,16,18)
InChIKeyKOZVLOYQISASCT-UHFFFAOYSA-N
MW278.42 g/mol
LogP3.19
Rot. Bonds2

About N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide

N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 53014818) has the molecular formula C15H22N2OS and a molecular weight of 278.42 g/mol. Its IUPAC name is N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide
PubChem CID53014818
Molecular FormulaC15H22N2OS
Molecular Weight278.42 g/mol
Exact Mass278.15
IUPAC NameN-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide
SMILESCN1CCCc2cc(C(=O)NC3CCCCC3)sc21
InChIInChI=1S/C15H22N2OS/c1-17-9-5-6-11-10-13(19-15(11)17)14(18)16-12-7-3-2-4-8-12/h10,12H,2-9H2,1H3,(H,16,18)
InChIKeyKOZVLOYQISASCT-UHFFFAOYSA-N
XLogP3.19
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide (CID 53014818) is N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide is CN1CCCc2cc(C(=O)NC3CCCCC3)sc21.
What is the InChIKey of N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is KOZVLOYQISASCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2OS/c1-17-9-5-6-11-10-13(19-15(11)17)14(18)16-12-7-3-2-4-8-12/h10,12H,2-9H2,1H3,(H,16,18).
What are the key properties of N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide?
N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 278.42 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-7-methyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 53014818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).