N-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide

C23H24N4O4 — CID 90011794

IUPACN-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESO=C(NCC1CC12CCN(C(=O)c1cc(C3CC3)on1)CC2)c1cc2ccncc2o1
InChIInChI=1S/C23H24N4O4/c28-21(19-9-15-3-6-24-13-20(15)30-19)25-12-16-11-23(16)4-7-27(8-5-23)22(29)17-10-18(31-26-17)14-1-2-14/h3,6,9-10,13-14,16H,1-2,4-5,7-8,11-12H2,(H,25,28)
InChIKeyNTFNVZBMBLQSCP-UHFFFAOYSA-N
MW420.47 g/mol
LogP3.37
Rot. Bonds5

About N-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide

N-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (PubChem CID 90011794) has the molecular formula C23H24N4O4 and a molecular weight of 420.47 g/mol. Its IUPAC name is N-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
PubChem CID90011794
Molecular FormulaC23H24N4O4
Molecular Weight420.47 g/mol
Exact Mass420.18
IUPAC NameN-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESO=C(NCC1CC12CCN(C(=O)c1cc(C3CC3)on1)CC2)c1cc2ccncc2o1
InChIInChI=1S/C23H24N4O4/c28-21(19-9-15-3-6-24-13-20(15)30-19)25-12-16-11-23(16)4-7-27(8-5-23)22(29)17-10-18(31-26-17)14-1-2-14/h3,6,9-10,13-14,16H,1-2,4-5,7-8,11-12H2,(H,25,28)
InChIKeyNTFNVZBMBLQSCP-UHFFFAOYSA-N
XLogP3.37
TPSA101.47 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.47
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (CID 90011794) is N-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for N-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is O=C(NCC1CC12CCN(C(=O)c1cc(C3CC3)on1)CC2)c1cc2ccncc2o1.
What is the InChIKey of N-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The InChIKey is NTFNVZBMBLQSCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O4/c28-21(19-9-15-3-6-24-13-20(15)30-19)25-12-16-11-23(16)4-7-27(8-5-23)22(29)17-10-18(31-26-17)14-1-2-14/h3,6,9-10,13-14,16H,1-2,4-5,7-8,11-12H2,(H,25,28).
What are the key properties of N-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
N-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide has a molecular weight of 420.47 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(5-cyclopropyl-1,2-oxazole-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 90011794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).