6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide

C22H20N6O — CID 124593484

IUPAC6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide
SMILESC[C@H]1C[C@H]1c1cc(NC(=O)c2ccc(-n3ccnc3)nc2)n(-c2ccccc2)n1
InChIInChI=1S/C22H20N6O/c1-15-11-18(15)19-12-21(28(26-19)17-5-3-2-4-6-17)25-22(29)16-7-8-20(24-13-16)27-10-9-23-14-27/h2-10,12-15,18H,11H2,1H3,(H,25,29)/t15-,18+/m0/s1
InChIKeyYWNCEVGJDFVTRY-MAUKXSAKSA-N
MW384.44 g/mol
LogP3.83
Rot. Bonds5

About 6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide

6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide (PubChem CID 124593484) has the molecular formula C22H20N6O and a molecular weight of 384.44 g/mol. Its IUPAC name is 6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide
PubChem CID124593484
Molecular FormulaC22H20N6O
Molecular Weight384.44 g/mol
Exact Mass384.17
IUPAC Name6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide
SMILESC[C@H]1C[C@H]1c1cc(NC(=O)c2ccc(-n3ccnc3)nc2)n(-c2ccccc2)n1
InChIInChI=1S/C22H20N6O/c1-15-11-18(15)19-12-21(28(26-19)17-5-3-2-4-6-17)25-22(29)16-7-8-20(24-13-16)27-10-9-23-14-27/h2-10,12-15,18H,11H2,1H3,(H,25,29)/t15-,18+/m0/s1
InChIKeyYWNCEVGJDFVTRY-MAUKXSAKSA-N
XLogP3.83
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide with MolForge

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Related Compounds

1-(4-bromophenyl)-3-[3-(2-methylcyclopropyl)-1-phenylpyrazol-5-yl]urea
CID 70789183
2-methyl-N-[3-[(1R,2R)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]-4-(1,2,4-triazol-1-yl)benzamide
CID 124593746
ethane;6-imidazol-1-yl-N-methylpyridine-3-carboxamide
CID 142231779
6-imidazol-1-yl-N-pyrazolo[1,5-a]pyrimidin-7-ylpyridine-3-carboxamide
CID 146121645
1-(3,5-dichlorophenyl)-3-[3-(2-methylcyclopropyl)-1-phenylpyrazol-5-yl]urea
CID 70789138
N-(3-cyclopropyl-1-phenylpyrazol-5-yl)pyridine-4-carboxamide
CID 71943773
N-(3-acetamido-2-methylphenyl)-6-imidazol-1-ylpyridine-3-carboxamide
CID 37064847
N-(benzhydrylideneamino)-6-imidazol-1-ylpyridine-3-carboxamide
CID 24665445
N-ethyl-6-imidazol-1-ylpyridine-3-carboxamide
CID 47152181
2-[(6-imidazol-1-ylpyridine-3-carbonyl)amino]propanoic acid
CID 43355195
4-acetamido-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)benzamide
CID 78830462
N-(2-chloro-4-methylphenyl)-6-imidazol-1-ylpyridine-3-carboxamide
CID 35374886

Frequently Asked Questions

What is the IUPAC name of 6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide?
The IUPAC name of 6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide (CID 124593484) is 6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide.
What is the SMILES notation for 6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide?
The canonical SMILES for 6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide is C[C@H]1C[C@H]1c1cc(NC(=O)c2ccc(-n3ccnc3)nc2)n(-c2ccccc2)n1.
What is the InChIKey of 6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide?
The InChIKey is YWNCEVGJDFVTRY-MAUKXSAKSA-N. The full InChI is InChI=1S/C22H20N6O/c1-15-11-18(15)19-12-21(28(26-19)17-5-3-2-4-6-17)25-22(29)16-7-8-20(24-13-16)27-10-9-23-14-27/h2-10,12-15,18H,11H2,1H3,(H,25,29)/t15-,18+/m0/s1.
What are the key properties of 6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide?
6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide has a molecular weight of 384.44 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazol-1-yl-N-[3-[(1R,2S)-2-methylcyclopropyl]-1-phenylpyrazol-5-yl]pyridine-3-carboxamide is sourced from PubChem (CID 124593484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).