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

C23H22N6O3 — CID 90011586

IUPACN-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESO=C(NCC1CC12CCN(C(=O)c1cnc3nc[nH]c3c1)CC2)c1cc2ccncc2o1
InChIInChI=1S/C23H22N6O3/c30-21(18-8-14-1-4-24-12-19(14)32-18)26-11-16-9-23(16)2-5-29(6-3-23)22(31)15-7-17-20(25-10-15)28-13-27-17/h1,4,7-8,10,12-13,16H,2-3,5-6,9,11H2,(H,26,30)(H,25,27,28)
InChIKeyGVPGSNRGZFLHQK-UHFFFAOYSA-N
MW430.47 g/mol
LogP2.77
Rot. Bonds4

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

N-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (PubChem CID 90011586) has the molecular formula C23H22N6O3 and a molecular weight of 430.47 g/mol. Its IUPAC name is N-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
PubChem CID90011586
Molecular FormulaC23H22N6O3
Molecular Weight430.47 g/mol
Exact Mass430.18
IUPAC NameN-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESO=C(NCC1CC12CCN(C(=O)c1cnc3nc[nH]c3c1)CC2)c1cc2ccncc2o1
InChIInChI=1S/C23H22N6O3/c30-21(18-8-14-1-4-24-12-19(14)32-18)26-11-16-9-23(16)2-5-29(6-3-23)22(31)15-7-17-20(25-10-15)28-13-27-17/h1,4,7-8,10,12-13,16H,2-3,5-6,9,11H2,(H,26,30)(H,25,27,28)
InChIKeyGVPGSNRGZFLHQK-UHFFFAOYSA-N
XLogP2.77
TPSA117.01 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.47
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (CID 90011586) is N-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for N-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is O=C(NCC1CC12CCN(C(=O)c1cnc3nc[nH]c3c1)CC2)c1cc2ccncc2o1.
What is the InChIKey of N-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The InChIKey is GVPGSNRGZFLHQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N6O3/c30-21(18-8-14-1-4-24-12-19(14)32-18)26-11-16-9-23(16)2-5-29(6-3-23)22(31)15-7-17-20(25-10-15)28-13-27-17/h1,4,7-8,10,12-13,16H,2-3,5-6,9,11H2,(H,26,30)(H,25,27,28).
What are the key properties of N-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
N-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide has a molecular weight of 430.47 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(1H-imidazo[4,5-b]pyridine-6-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 90011586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).