N-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide

C23H25N3O4 — CID 155437264

IUPACN-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCOc1cc2nc(C3CCOCC3)cn2cc1C(=O)Nc1cccc2c1CCOC2
InChIInChI=1S/C23H25N3O4/c1-28-21-11-22-24-20(15-5-8-29-9-6-15)13-26(22)12-18(21)23(27)25-19-4-2-3-16-14-30-10-7-17(16)19/h2-4,11-13,15H,5-10,14H2,1H3,(H,25,27)
InChIKeyIMPQWBPIPMXQJC-UHFFFAOYSA-N
MW407.47 g/mol
LogP3.56
Rot. Bonds4

About N-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide

N-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 155437264) has the molecular formula C23H25N3O4 and a molecular weight of 407.47 g/mol. Its IUPAC name is N-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID155437264
Molecular FormulaC23H25N3O4
Molecular Weight407.47 g/mol
Exact Mass407.18
IUPAC NameN-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCOc1cc2nc(C3CCOCC3)cn2cc1C(=O)Nc1cccc2c1CCOC2
InChIInChI=1S/C23H25N3O4/c1-28-21-11-22-24-20(15-5-8-29-9-6-15)13-26(22)12-18(21)23(27)25-19-4-2-3-16-14-30-10-7-17(16)19/h2-4,11-13,15H,5-10,14H2,1H3,(H,25,27)
InChIKeyIMPQWBPIPMXQJC-UHFFFAOYSA-N
XLogP3.56
TPSA74.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.47
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2,3-dihydro-1-benzofuran-7-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
CID 155437027
N-(3,4-dihydro-2H-chromen-8-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
CID 155437237
N-(3-chlorophenyl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
CID 155437280
7-methoxy-2-(oxan-4-yl)-N-pyrazolo[1,5-a]pyridin-7-ylimidazo[1,2-a]pyridine-6-carboxamide
CID 155437007
N-(3,4-difluoro-2-methylphenyl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
CID 155437415
7-methoxy-N-(3-methyl-1,2-thiazol-4-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
CID 155438506
7-methoxy-2-(oxan-4-yl)-N-(1,2-thiazol-5-yl)imidazo[1,2-a]pyridine-6-carboxamide
CID 155437335
N-(1-cyclopentylpyrazol-3-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
CID 155437383
N-[1-(difluoromethyl)pyrazol-3-yl]-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide;2,2,2-trifluoroacetic acid
CID 155749135
7-cyclopentyloxy-2-cyclopropyl-N-(6-methoxy-2-pyridinyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 167419980
6-bromo-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine
CID 155188182
ethane;molecular hydrogen;N-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]-2,3-dihydro-1-benzofuran-7-carboxamide;N-[2-(oxan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]-6-(oxolan-3-yl)pyridine-2-carboxamide
CID 154655439

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide (CID 155437264) is N-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide is COc1cc2nc(C3CCOCC3)cn2cc1C(=O)Nc1cccc2c1CCOC2.
What is the InChIKey of N-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is IMPQWBPIPMXQJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O4/c1-28-21-11-22-24-20(15-5-8-29-9-6-15)13-26(22)12-18(21)23(27)25-19-4-2-3-16-14-30-10-7-17(16)19/h2-4,11-13,15H,5-10,14H2,1H3,(H,25,27).
What are the key properties of N-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide?
N-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 407.47 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-1H-isochromen-5-yl)-7-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 155437264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).