N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide

C21H23N3O3 — CID 154655160

IUPACN-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide
SMILESCCOc1cc2nc(CC)cn2cc1NC(=O)c1ccc2c(c1)CCOC2
InChIInChI=1S/C21H23N3O3/c1-3-17-11-24-12-18(19(27-4-2)10-20(24)22-17)23-21(25)15-5-6-16-13-26-8-7-14(16)9-15/h5-6,9-12H,3-4,7-8,13H2,1-2H3,(H,23,25)
InChIKeyJCSTYSKHGSVXRE-UHFFFAOYSA-N
MW365.43 g/mol
LogP3.62
Rot. Bonds5

About N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide

N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide (PubChem CID 154655160) has the molecular formula C21H23N3O3 and a molecular weight of 365.43 g/mol. Its IUPAC name is N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide.

Molecular Properties

Compound NameN-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide
PubChem CID154655160
Molecular FormulaC21H23N3O3
Molecular Weight365.43 g/mol
Exact Mass365.17
IUPAC NameN-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide
SMILESCCOc1cc2nc(CC)cn2cc1NC(=O)c1ccc2c(c1)CCOC2
InChIInChI=1S/C21H23N3O3/c1-3-17-11-24-12-18(19(27-4-2)10-20(24)22-17)23-21(25)15-5-6-16-13-26-8-7-14(16)9-15/h5-6,9-12H,3-4,7-8,13H2,1-2H3,(H,23,25)
InChIKeyJCSTYSKHGSVXRE-UHFFFAOYSA-N
XLogP3.62
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.43
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3,4-dihydro-1H-isochromen-6-yl)-2-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)ethanone
CID 165107495
N-[7-ethoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-2,3-dihydrofuro[2,3-b]pyridine-5-carboxamide
CID 154655849
6-acetamido-N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)pyridine-2-carboxamide
CID 154655727
N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 24617344
N-[7-ethoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-1-propan-2-ylpyrazole-3-carboxamide
CID 154655076
N-[2-(3,3-difluorocyclobutyl)-7-ethoxyimidazo[1,2-a]pyridin-6-yl]-6-methylpyridine-2-carboxamide
CID 164996643
3,4-dichloro-N-(2,5-diethoxy-4-morpholin-4-ylphenyl)benzamide
CID 4853152
methyl 3-[6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-7-ethoxyimidazo[1,2-a]pyridin-2-yl]propanoate
CID 154655144
N-[2-(3,3-difluorocyclobutyl)-7-ethoxyimidazo[1,2-a]pyridin-6-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 154655358
N-(2-ethoxyphenyl)-2-(2-morpholin-4-ylethylamino)pyridine-4-carboxamide
CID 109168105
4-chloro-N-(2,5-diethoxy-4-morpholin-4-ylphenyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 26701955
4-tert-butyl-N-(3-ethoxy-5,6,7,8-tetrahydronaphthalen-2-yl)benzamide
CID 164614809

Frequently Asked Questions

What is the IUPAC name of N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide?
The IUPAC name of N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide (CID 154655160) is N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide.
What is the SMILES notation for N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide?
The canonical SMILES for N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide is CCOc1cc2nc(CC)cn2cc1NC(=O)c1ccc2c(c1)CCOC2.
What is the InChIKey of N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide?
The InChIKey is JCSTYSKHGSVXRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O3/c1-3-17-11-24-12-18(19(27-4-2)10-20(24)22-17)23-21(25)15-5-6-16-13-26-8-7-14(16)9-15/h5-6,9-12H,3-4,7-8,13H2,1-2H3,(H,23,25).
What are the key properties of N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide?
N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide has a molecular weight of 365.43 g/mol, XLogP of 3.62, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-ethoxy-2-ethylimidazo[1,2-a]pyridin-6-yl)-3,4-dihydro-1H-isochromene-6-carboxamide is sourced from PubChem (CID 154655160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).