(1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide

C18H24N4O3 — CID 125139995

IUPAC(1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide
SMILESC[C@H]1OCC[C@@]12CN(C(=O)NCCc1cn3ccccc3n1)CCO2
InChIInChI=1S/C18H24N4O3/c1-14-18(6-10-24-14)13-22(9-11-25-18)17(23)19-7-5-15-12-21-8-3-2-4-16(21)20-15/h2-4,8,12,14H,5-7,9-11,13H2,1H3,(H,19,23)/t14-,18-/m1/s1
InChIKeyKUTCXZOFHAVWBJ-RDTXWAMCSA-N
MW344.41 g/mol
LogP1.47
Rot. Bonds3

About (1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide

(1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide (PubChem CID 125139995) has the molecular formula C18H24N4O3 and a molecular weight of 344.41 g/mol. Its IUPAC name is (1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide.

Molecular Properties

Compound Name(1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide
PubChem CID125139995
Molecular FormulaC18H24N4O3
Molecular Weight344.41 g/mol
Exact Mass344.18
IUPAC Name(1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide
SMILESC[C@H]1OCC[C@@]12CN(C(=O)NCCc1cn3ccccc3n1)CCO2
InChIInChI=1S/C18H24N4O3/c1-14-18(6-10-24-14)13-22(9-11-25-18)17(23)19-7-5-15-12-21-8-3-2-4-16(21)20-15/h2-4,8,12,14H,5-7,9-11,13H2,1H3,(H,19,23)/t14-,18-/m1/s1
InChIKeyKUTCXZOFHAVWBJ-RDTXWAMCSA-N
XLogP1.47
TPSA68.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

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N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-methyl-2,3-dihydroindole-1-carboxamide
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(2E,4E)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)hexa-2,4-dienamide
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Frequently Asked Questions

What is the IUPAC name of (1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide?
The IUPAC name of (1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide (CID 125139995) is (1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide.
What is the SMILES notation for (1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide?
The canonical SMILES for (1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide is C[C@H]1OCC[C@@]12CN(C(=O)NCCc1cn3ccccc3n1)CCO2.
What is the InChIKey of (1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide?
The InChIKey is KUTCXZOFHAVWBJ-RDTXWAMCSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-14-18(6-10-24-14)13-22(9-11-25-18)17(23)19-7-5-15-12-21-8-3-2-4-16(21)20-15/h2-4,8,12,14H,5-7,9-11,13H2,1H3,(H,19,23)/t14-,18-/m1/s1.
What are the key properties of (1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide?
(1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide has a molecular weight of 344.41 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,5R)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-methyl-2,6-dioxa-9-azaspiro[4.5]decane-9-carboxamide is sourced from PubChem (CID 125139995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).