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

C16H24N2OS — CID 53014826

IUPACN-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide
SMILESCCN1CCCc2cc(C(=O)NC3CCCCC3)sc21
InChIInChI=1S/C16H24N2OS/c1-2-18-10-6-7-12-11-14(20-16(12)18)15(19)17-13-8-4-3-5-9-13/h11,13H,2-10H2,1H3,(H,17,19)
InChIKeySIJIZOXOEMVLLK-UHFFFAOYSA-N
MW292.45 g/mol
LogP3.58
Rot. Bonds3

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

N-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 53014826) has the molecular formula C16H24N2OS and a molecular weight of 292.45 g/mol. Its IUPAC name is N-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide
PubChem CID53014826
Molecular FormulaC16H24N2OS
Molecular Weight292.45 g/mol
Exact Mass292.16
IUPAC NameN-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide
SMILESCCN1CCCc2cc(C(=O)NC3CCCCC3)sc21
InChIInChI=1S/C16H24N2OS/c1-2-18-10-6-7-12-11-14(20-16(12)18)15(19)17-13-8-4-3-5-9-13/h11,13H,2-10H2,1H3,(H,17,19)
InChIKeySIJIZOXOEMVLLK-UHFFFAOYSA-N
XLogP3.58
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide
CID 761867
N-[4-(4-methylpiperidine-1-carbonyl)phenyl]thiophene-2-carboxamide
CID 885311
N-(3-Methylbutyl)-4-oxo-4H,5H-thieno[3,2-C]quinoline-2-carboxamide
CID 5147248
N-[3-(diethylcarbamoyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 9266297
5-ethyl-N-isopropyl-4-oxo-4,5-dihydrothieno[3,2-c]quinoline-2-carboxamide
CID 16193902
5-Ethyl-N-(3-methylbutyl)-4-oxo-4H,5H-thieno[3,2-C]quinoline-2-carboxamide
CID 20865361
2-(Benzoylamino)-N-isopropyl-4,5-dimethyl-3-thiophenecarboxamide
CID 569946
N-{3-[(diethylamino)methyl]-4,5-dimethylthiophen-2-yl}benzamide
CID 833802
N-isopropyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
CID 687094
N-{4,5-dimethyl-3-[(2-methyl-1-piperidinyl)methyl]-2-thienyl}-2-fluorobenzamide
CID 4395058
N-[4,5-dimethyl-3-(1-piperidinylmethyl)-2-thienyl]-2-fluorobenzamide
CID 852250
(3-tert-butyl-5,6-dimethyl-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)(phenyl)methanone
CID 959556

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of N-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide (CID 53014826) is N-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide is CCN1CCCc2cc(C(=O)NC3CCCCC3)sc21.
What is the InChIKey of N-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is SIJIZOXOEMVLLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS/c1-2-18-10-6-7-12-11-14(20-16(12)18)15(19)17-13-8-4-3-5-9-13/h11,13H,2-10H2,1H3,(H,17,19).
What are the key properties of N-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide?
N-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 292.45 g/mol, XLogP of 3.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-7-ethyl-5,6-dihydro-4H-thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 53014826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).