N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide

C24H24N6O4 — CID 118621274

IUPACN-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESCn1cc(-c2ccno2)c(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3ccncc3o2)n1
InChIInChI=1S/C24H24N6O4/c1-29-14-17(18-3-7-27-34-18)21(28-29)23(32)30-8-4-24(5-9-30)11-16(24)12-26-22(31)19-10-15-2-6-25-13-20(15)33-19/h2-3,6-7,10,13-14,16H,4-5,8-9,11-12H2,1H3,(H,26,31)
InChIKeySVFNBEXXYZWQSU-UHFFFAOYSA-N
MW460.49 g/mol
LogP2.89
Rot. Bonds5

About N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide

N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (PubChem CID 118621274) has the molecular formula C24H24N6O4 and a molecular weight of 460.49 g/mol. Its IUPAC name is N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
PubChem CID118621274
Molecular FormulaC24H24N6O4
Molecular Weight460.49 g/mol
Exact Mass460.19
IUPAC NameN-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESCn1cc(-c2ccno2)c(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3ccncc3o2)n1
InChIInChI=1S/C24H24N6O4/c1-29-14-17(18-3-7-27-34-18)21(28-29)23(32)30-8-4-24(5-9-30)11-16(24)12-26-22(31)19-10-15-2-6-25-13-20(15)33-19/h2-3,6-7,10,13-14,16H,4-5,8-9,11-12H2,1H3,(H,26,31)
InChIKeySVFNBEXXYZWQSU-UHFFFAOYSA-N
XLogP2.89
TPSA119.29 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.49
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (CID 118621274) is N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-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-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is Cn1cc(-c2ccno2)c(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3ccncc3o2)n1.
What is the InChIKey of N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The InChIKey is SVFNBEXXYZWQSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N6O4/c1-29-14-17(18-3-7-27-34-18)21(28-29)23(32)30-8-4-24(5-9-30)11-16(24)12-26-22(31)19-10-15-2-6-25-13-20(15)33-19/h2-3,6-7,10,13-14,16H,4-5,8-9,11-12H2,1H3,(H,26,31).
What are the key properties of N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide has a molecular weight of 460.49 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-[1-methyl-4-(1,2-oxazol-5-yl)pyrazole-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 118621274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).