N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide

C15H16N4OS — CID 53143755

IUPACN-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide
SMILESCCn1c(CCNC(=O)c2ccsc2)nc2cccnc21
InChIInChI=1S/C15H16N4OS/c1-2-19-13(18-12-4-3-7-16-14(12)19)5-8-17-15(20)11-6-9-21-10-11/h3-4,6-7,9-10H,2,5,8H2,1H3,(H,17,20)
InChIKeyZRIRHFVWCAJTIH-UHFFFAOYSA-N
MW300.39 g/mol
LogP2.49
Rot. Bonds5

About N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide

N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide (PubChem CID 53143755) has the molecular formula C15H16N4OS and a molecular weight of 300.39 g/mol. Its IUPAC name is N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide.

Molecular Properties

Compound NameN-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide
PubChem CID53143755
Molecular FormulaC15H16N4OS
Molecular Weight300.39 g/mol
Exact Mass300.10
IUPAC NameN-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide
SMILESCCn1c(CCNC(=O)c2ccsc2)nc2cccnc21
InChIInChI=1S/C15H16N4OS/c1-2-19-13(18-12-4-3-7-16-14(12)19)5-8-17-15(20)11-6-9-21-10-11/h3-4,6-7,9-10H,2,5,8H2,1H3,(H,17,20)
InChIKeyZRIRHFVWCAJTIH-UHFFFAOYSA-N
XLogP2.49
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.39
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-3-fluorobenzamide
CID 71842734
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-phenylbutanamide
CID 53143748
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-2-(3-fluorophenyl)acetamide
CID 53143754
N-[3-[(1-ethylbenzimidazol-2-yl)methylamino]-3-oxopropyl]thiophene-3-carboxamide
CID 18116720
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]cyclopropanamine
CID 63758859
2-methoxy-N-[2-(3-propylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide
CID 71842723
2,4-dimethyl-N-[2-(3-propylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide
CID 71842715
2-butyl-3-ethylimidazo[4,5-b]pyridine
CID 150562237
N-[2-[2-(2-phenylethyl)imidazo[4,5-b]pyridin-3-yl]ethyl]benzamide
CID 83278481
[(3R)-3-(3-ethylimidazo[4,5-b]pyridin-2-yl)pyrrolidin-1-yl]-thiophen-3-ylmethanone
CID 95110108
2-methoxy-N-[2-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]ethyl]benzamide
CID 50843507
N-[2-(thiophene-3-carbonylamino)ethyl]thiophene-3-carboxamide
CID 101004058

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide?
The IUPAC name of N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide (CID 53143755) is N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide.
What is the SMILES notation for N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide?
The canonical SMILES for N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide is CCn1c(CCNC(=O)c2ccsc2)nc2cccnc21.
What is the InChIKey of N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide?
The InChIKey is ZRIRHFVWCAJTIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4OS/c1-2-19-13(18-12-4-3-7-16-14(12)19)5-8-17-15(20)11-6-9-21-10-11/h3-4,6-7,9-10H,2,5,8H2,1H3,(H,17,20).
What are the key properties of N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide?
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide has a molecular weight of 300.39 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]thiophene-3-carboxamide is sourced from PubChem (CID 53143755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).