N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide

C24H23N7O5 — CID 176594538

IUPACN-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
SMILESCOc1ncc(-c2ccc3nc(NC(=O)CO)cn3n2)cc1NC(=O)N1OCCC1c1ccccc1
InChIInChI=1S/C24H23N7O5/c1-35-23-18(26-24(34)31-19(9-10-36-31)15-5-3-2-4-6-15)11-16(12-25-23)17-7-8-21-27-20(13-30(21)29-17)28-22(33)14-32/h2-8,11-13,19,32H,9-10,14H2,1H3,(H,26,34)(H,28,33)
InChIKeyJFCOHIKBIJKYQU-UHFFFAOYSA-N
MW489.49 g/mol
LogP2.64
Rot. Bonds6

About N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide

N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide (PubChem CID 176594538) has the molecular formula C24H23N7O5 and a molecular weight of 489.49 g/mol. Its IUPAC name is N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide.

Molecular Properties

Compound NameN-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
PubChem CID176594538
Molecular FormulaC24H23N7O5
Molecular Weight489.49 g/mol
Exact Mass489.18
IUPAC NameN-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
SMILESCOc1ncc(-c2ccc3nc(NC(=O)CO)cn3n2)cc1NC(=O)N1OCCC1c1ccccc1
InChIInChI=1S/C24H23N7O5/c1-35-23-18(26-24(34)31-19(9-10-36-31)15-5-3-2-4-6-15)11-16(12-25-23)17-7-8-21-27-20(13-30(21)29-17)28-22(33)14-32/h2-8,11-13,19,32H,9-10,14H2,1H3,(H,26,34)(H,28,33)
InChIKeyJFCOHIKBIJKYQU-UHFFFAOYSA-N
XLogP2.64
TPSA143.21 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500489.49
LogP ≤ 52.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Analyze N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide with MolForge

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Related Compounds

N-[5-[2-[[(1S,2S)-2-fluorocyclopropanecarbonyl]amino]imidazo[1,2-b]pyridazin-6-yl]-2-methylphenyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
CID 176594458
N-[5-(2-acetamido-1,3-benzothiazol-6-yl)-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
CID 176594547
N-[5-(2-amino-1,3-benzoxazol-6-yl)-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
CID 176594517
N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methoxyphenyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
CID 176594506
N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methyl-3-pyridinyl]-3-(4-methoxyphenyl)-1,2-oxazolidine-2-carboxamide
CID 176594560
N-[5-[4-amino-5-(trifluoromethyl)pyrrolo[2,1-f][1,2,4]triazin-7-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide
CID 176594505
2-cyclohexyl-N-[6-(3-methoxyphenyl)imidazo[1,2-b]pyridazin-2-yl]acetamide
CID 143879129
(3S)-N-[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-2-methylphenyl]-3-(4-methylphenyl)-1,2-oxazolidine-2-carboxamide
CID 176594482
phenyl N-[6-[5-(difluoromethoxy)-6-methoxy-3-pyridinyl]imidazo[1,2-b]pyridazin-2-yl]carbamate
CID 176898184
2-methoxy-5-[2-(prop-2-enoylamino)imidazo[1,2-b]pyridazin-6-yl]pyridine-3-carboxylic acid
CID 175439945
N,3-diphenyl-1,2-oxazolidine-2-carboxamide
CID 154595659
2-methyl-5-[2-[(2-phenylmethoxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]pyridine-3-carboxylic acid
CID 142580998

Frequently Asked Questions

What is the IUPAC name of N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide?
The IUPAC name of N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide (CID 176594538) is N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide.
What is the SMILES notation for N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide?
The canonical SMILES for N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide is COc1ncc(-c2ccc3nc(NC(=O)CO)cn3n2)cc1NC(=O)N1OCCC1c1ccccc1.
What is the InChIKey of N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide?
The InChIKey is JFCOHIKBIJKYQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N7O5/c1-35-23-18(26-24(34)31-19(9-10-36-31)15-5-3-2-4-6-15)11-16(12-25-23)17-7-8-21-27-20(13-30(21)29-17)28-22(33)14-32/h2-8,11-13,19,32H,9-10,14H2,1H3,(H,26,34)(H,28,33).
What are the key properties of N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide?
N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide has a molecular weight of 489.49 g/mol, XLogP of 2.64, 6 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-[(2-hydroxyacetyl)amino]imidazo[1,2-b]pyridazin-6-yl]-2-methoxy-3-pyridinyl]-3-phenyl-1,2-oxazolidine-2-carboxamide is sourced from PubChem (CID 176594538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).