6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

C26H24N4O4 — CID 55718327

IUPAC6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCCNC(=O)COc1ccc(NC(=O)c2cc(C3CC3)nc3onc(-c4ccccc4)c23)cc1
InChIInChI=1S/C26H24N4O4/c1-2-27-22(31)15-33-19-12-10-18(11-13-19)28-25(32)20-14-21(16-8-9-16)29-26-23(20)24(30-34-26)17-6-4-3-5-7-17/h3-7,10-14,16H,2,8-9,15H2,1H3,(H,27,31)(H,28,32)
InChIKeyUVRJALIPXRPUSM-UHFFFAOYSA-N
MW456.50 g/mol
LogP4.53
Rot. Bonds8

About 6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 55718327) has the molecular formula C26H24N4O4 and a molecular weight of 456.50 g/mol. Its IUPAC name is 6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
PubChem CID55718327
Molecular FormulaC26H24N4O4
Molecular Weight456.50 g/mol
Exact Mass456.18
IUPAC Name6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
SMILESCCNC(=O)COc1ccc(NC(=O)c2cc(C3CC3)nc3onc(-c4ccccc4)c23)cc1
InChIInChI=1S/C26H24N4O4/c1-2-27-22(31)15-33-19-12-10-18(11-13-19)28-25(32)20-14-21(16-8-9-16)29-26-23(20)24(30-34-26)17-6-4-3-5-7-17/h3-7,10-14,16H,2,8-9,15H2,1H3,(H,27,31)(H,28,32)
InChIKeyUVRJALIPXRPUSM-UHFFFAOYSA-N
XLogP4.53
TPSA106.35 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.50
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide with MolForge

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Related Compounds

6-cyclopropyl-N-[2-(ethylamino)-2-oxoethyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 55719868
6-cyclopropyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 55756409
6-cyclopropyl-N-(2-fluorophenyl)-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 171315355
N-[(3-acetamidophenyl)methyl]-6-cyclopropyl-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 55721721
methyl (2S)-2-[(6-cyclopropyl-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carbonyl)amino]-2-phenylacetate
CID 167915655
6-cyclopropyl-3-(4-methoxyphenyl)-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 44824721
N-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-6-cyclopropyl-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 55908456
6-cyclopropyl-N-[cyclopropyl(phenyl)methyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 166393903
6-cyclopropyl-N-(furan-2-ylmethyl)-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 55719913
6-cyclopropyl-N-[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]-3-(4-methoxyphenyl)-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 44824825
6-cyclopropyl-N-[(1R)-1-(2-fluorophenyl)propyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 166393896
6-cyclopropyl-N-[(2,3-dimethoxyphenyl)methyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 55718526

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide (CID 55718327) is 6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is CCNC(=O)COc1ccc(NC(=O)c2cc(C3CC3)nc3onc(-c4ccccc4)c23)cc1.
What is the InChIKey of 6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is UVRJALIPXRPUSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N4O4/c1-2-27-22(31)15-33-19-12-10-18(11-13-19)28-25(32)20-14-21(16-8-9-16)29-26-23(20)24(30-34-26)17-6-4-3-5-7-17/h3-7,10-14,16H,2,8-9,15H2,1H3,(H,27,31)(H,28,32).
What are the key properties of 6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 456.50 g/mol, XLogP of 4.53, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 55718327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).