N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide

C23H19N5O3 — CID 33492536

IUPACN-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide
SMILESCOc1cc(NC(=O)c2ccc(-n3cccn3)cc2)ccc1NC(=O)c1cccnc1
InChIInChI=1S/C23H19N5O3/c1-31-21-14-18(7-10-20(21)27-23(30)17-4-2-11-24-15-17)26-22(29)16-5-8-19(9-6-16)28-13-3-12-25-28/h2-15H,1H3,(H,26,29)(H,27,30)
InChIKeyYDNSJCSGMQRTLE-UHFFFAOYSA-N
MW413.44 g/mol
LogP3.78
Rot. Bonds6

About N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide

N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide (PubChem CID 33492536) has the molecular formula C23H19N5O3 and a molecular weight of 413.44 g/mol. Its IUPAC name is N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide
PubChem CID33492536
Molecular FormulaC23H19N5O3
Molecular Weight413.44 g/mol
Exact Mass413.15
IUPAC NameN-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide
SMILESCOc1cc(NC(=O)c2ccc(-n3cccn3)cc2)ccc1NC(=O)c1cccnc1
InChIInChI=1S/C23H19N5O3/c1-31-21-14-18(7-10-20(21)27-23(30)17-4-2-11-24-15-17)26-22(29)16-5-8-19(9-6-16)28-13-3-12-25-28/h2-15H,1H3,(H,26,29)(H,27,30)
InChIKeyYDNSJCSGMQRTLE-UHFFFAOYSA-N
XLogP3.78
TPSA98.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.44
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-methoxy-4-[(5-methyl-1-phenylpyrazole-3-carbonyl)amino]phenyl]pyridine-3-carboxamide
CID 55760872
N-[2-methoxy-4-(pentanoylamino)phenyl]pyridine-3-carboxamide
CID 38661659
N-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]-2-oxo-1H-pyridine-3-carboxamide
CID 38659868
N-[2-methoxy-4-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]phenyl]pyridine-3-carboxamide
CID 2852997
N-[4-[[4-(dimethylamino)-3-fluorobenzoyl]amino]-2-methoxyphenyl]pyridine-3-carboxamide
CID 47783030
N-[4-[[3-(dimethylsulfamoyl)-4-methoxybenzoyl]amino]-2-methoxyphenyl]pyridine-3-carboxamide
CID 55653581
N-[2-methoxy-4-[[2-(4-methylphenyl)sulfanylacetyl]amino]phenyl]pyridine-3-carboxamide
CID 33491810
N-[4-(4-benzamidobutanoylamino)-2-methoxyphenyl]pyridine-3-carboxamide
CID 33492420
N-[4-[(2-amino-3-methylbutanoyl)amino]-2-methoxyphenyl]pyridine-3-carboxamide
CID 119845805
N-[3-methoxy-4-(pyridine-3-carbonylamino)phenyl]quinoline-2-carboxamide
CID 38661634
3-methoxy-N-(4-pyrazol-1-ylphenyl)benzamide
CID 31923113
N-[4-(1-benzofuran-2-carbonylamino)-3-methoxyphenyl]pyridine-3-carboxamide
CID 1227074

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide (CID 33492536) is N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide is COc1cc(NC(=O)c2ccc(-n3cccn3)cc2)ccc1NC(=O)c1cccnc1.
What is the InChIKey of N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide?
The InChIKey is YDNSJCSGMQRTLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N5O3/c1-31-21-14-18(7-10-20(21)27-23(30)17-4-2-11-24-15-17)26-22(29)16-5-8-19(9-6-16)28-13-3-12-25-28/h2-15H,1H3,(H,26,29)(H,27,30).
What are the key properties of N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide?
N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide has a molecular weight of 413.44 g/mol, XLogP of 3.78, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-4-[(4-pyrazol-1-ylbenzoyl)amino]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 33492536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).