5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide

C27H23N7O3 — CID 71044117

IUPAC5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide
SMILESNc1cc(C(=O)Nc2cccc(Oc3ccc4nc(NC(=O)C5CC5)cn4c3)c2)nn1-c1ccccc1
InChIInChI=1S/C27H23N7O3/c28-23-14-22(32-34(23)19-6-2-1-3-7-19)27(36)29-18-5-4-8-20(13-18)37-21-11-12-25-30-24(16-33(25)15-21)31-26(35)17-9-10-17/h1-8,11-17H,9-10,28H2,(H,29,36)(H,31,35)
InChIKeySMNIFRUCKJIGMX-UHFFFAOYSA-N
MW493.53 g/mol
LogP4.50
Rot. Bonds7

About 5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide

5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide (PubChem CID 71044117) has the molecular formula C27H23N7O3 and a molecular weight of 493.53 g/mol. Its IUPAC name is 5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide.

Molecular Properties

Compound Name5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide
PubChem CID71044117
Molecular FormulaC27H23N7O3
Molecular Weight493.53 g/mol
Exact Mass493.19
IUPAC Name5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide
SMILESNc1cc(C(=O)Nc2cccc(Oc3ccc4nc(NC(=O)C5CC5)cn4c3)c2)nn1-c1ccccc1
InChIInChI=1S/C27H23N7O3/c28-23-14-22(32-34(23)19-6-2-1-3-7-19)27(36)29-18-5-4-8-20(13-18)37-21-11-12-25-30-24(16-33(25)15-21)31-26(35)17-9-10-17/h1-8,11-17H,9-10,28H2,(H,29,36)(H,31,35)
InChIKeySMNIFRUCKJIGMX-UHFFFAOYSA-N
XLogP4.50
TPSA128.57 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms37
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500493.53
LogP ≤ 54.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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Related Compounds

6-amino-N-[4-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxy-3-fluorophenyl]-2-oxo-1-phenylpyridine-3-carboxamide
CID 143889998
N-[4-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxy-3-fluorophenyl]-2-oxo-1-phenylpyridine-3-carboxamide
CID 66968949
N-[4-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide
CID 58158574
N-[6-(3-chloro-4-nitrophenoxy)imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide
CID 58158527
benzyl-[4-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxy-2-fluorophenyl]carbamic acid
CID 66968948
N-[4-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxy-3-fluorophenyl]-6-methyl-1-(3-methylphenyl)-2-oxopyridine-3-carboxamide
CID 58158493
N-[4-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxy-3-fluorophenyl]-3-(4-fluorophenyl)-2-oxoimidazolidine-1-carboxamide
CID 58158620
5-(cyclopropanecarbonylamino)-N-(4-ethoxyphenyl)-1-phenylpyrazole-3-carboxamide
CID 51998569
N-[4-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxy-3-fluorophenyl]-1-(4-fluoro-2-methylphenyl)-2-oxopyridine-3-carboxamide
CID 58158554
3-(cyclopropanecarbonylamino)-N-(4-phenoxyphenyl)benzamide
CID 34757379
N-[4-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxy-3-fluorophenyl]-1-(4-fluorophenyl)-5,6-dimethyl-2-oxopyridine-3-carboxamide
CID 58158592
N-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)cyclopropanecarboxamide
CID 58158532

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide?
The IUPAC name of 5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide (CID 71044117) is 5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide.
What is the SMILES notation for 5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide?
The canonical SMILES for 5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide is Nc1cc(C(=O)Nc2cccc(Oc3ccc4nc(NC(=O)C5CC5)cn4c3)c2)nn1-c1ccccc1.
What is the InChIKey of 5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide?
The InChIKey is SMNIFRUCKJIGMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23N7O3/c28-23-14-22(32-34(23)19-6-2-1-3-7-19)27(36)29-18-5-4-8-20(13-18)37-21-11-12-25-30-24(16-33(25)15-21)31-26(35)17-9-10-17/h1-8,11-17H,9-10,28H2,(H,29,36)(H,31,35).
What are the key properties of 5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide?
5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide has a molecular weight of 493.53 g/mol, XLogP of 4.50, 7 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxyphenyl]-1-phenylpyrazole-3-carboxamide is sourced from PubChem (CID 71044117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).