N-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide

C23H30N4O4 — CID 71715749

IUPACN-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESCC(C(=O)N1CCC2(CC1)CC2CNC(=O)c1cc2ccncc2o1)N1CCOCC1
InChIInChI=1S/C23H30N4O4/c1-16(26-8-10-30-11-9-26)22(29)27-6-3-23(4-7-27)13-18(23)14-25-21(28)19-12-17-2-5-24-15-20(17)31-19/h2,5,12,15-16,18H,3-4,6-11,13-14H2,1H3,(H,25,28)
InChIKeyNUCLDSOKVBPEIK-UHFFFAOYSA-N
MW426.52 g/mol
LogP1.91
Rot. Bonds5

About N-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide

N-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (PubChem CID 71715749) has the molecular formula C23H30N4O4 and a molecular weight of 426.52 g/mol. Its IUPAC name is N-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
PubChem CID71715749
Molecular FormulaC23H30N4O4
Molecular Weight426.52 g/mol
Exact Mass426.23
IUPAC NameN-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESCC(C(=O)N1CCC2(CC1)CC2CNC(=O)c1cc2ccncc2o1)N1CCOCC1
InChIInChI=1S/C23H30N4O4/c1-16(26-8-10-30-11-9-26)22(29)27-6-3-23(4-7-27)13-18(23)14-25-21(28)19-12-17-2-5-24-15-20(17)31-19/h2,5,12,15-16,18H,3-4,6-11,13-14H2,1H3,(H,25,28)
InChIKeyNUCLDSOKVBPEIK-UHFFFAOYSA-N
XLogP1.91
TPSA87.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.52
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (CID 71715749) is N-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for N-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is CC(C(=O)N1CCC2(CC1)CC2CNC(=O)c1cc2ccncc2o1)N1CCOCC1.
What is the InChIKey of N-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The InChIKey is NUCLDSOKVBPEIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O4/c1-16(26-8-10-30-11-9-26)22(29)27-6-3-23(4-7-27)13-18(23)14-25-21(28)19-12-17-2-5-24-15-20(17)31-19/h2,5,12,15-16,18H,3-4,6-11,13-14H2,1H3,(H,25,28).
What are the key properties of N-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
N-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide has a molecular weight of 426.52 g/mol, XLogP of 1.91, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(2-morpholin-4-ylpropanoyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 71715749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).