N-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide

C22H18N4O2 — CID 8890850

IUPACN-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide
SMILESO=C(Nc1ccnn1Cc1ccccc1)c1cccnc1Oc1ccccc1
InChIInChI=1S/C22H18N4O2/c27-21(19-12-7-14-23-22(19)28-18-10-5-2-6-11-18)25-20-13-15-24-26(20)16-17-8-3-1-4-9-17/h1-15H,16H2,(H,25,27)
InChIKeyUKBKFIJVGOCISH-UHFFFAOYSA-N
MW370.41 g/mol
LogP4.37
Rot. Bonds6

About N-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide

N-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide (PubChem CID 8890850) has the molecular formula C22H18N4O2 and a molecular weight of 370.41 g/mol. Its IUPAC name is N-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide
PubChem CID8890850
Molecular FormulaC22H18N4O2
Molecular Weight370.41 g/mol
Exact Mass370.14
IUPAC NameN-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide
SMILESO=C(Nc1ccnn1Cc1ccccc1)c1cccnc1Oc1ccccc1
InChIInChI=1S/C22H18N4O2/c27-21(19-12-7-14-23-22(19)28-18-10-5-2-6-11-18)25-20-13-15-24-26(20)16-17-8-3-1-4-9-17/h1-15H,16H2,(H,25,27)
InChIKeyUKBKFIJVGOCISH-UHFFFAOYSA-N
XLogP4.37
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-benzylpyrazol-3-yl)-2-iodobenzamide
CID 55359617
2-phenylsulfanyl-N-[2-(pyridin-3-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide
CID 18775282
N-(2-benzylpyrazol-3-yl)-3,4-dichlorobenzamide
CID 7589760
N-(2-benzylpyrazol-3-yl)-4-iodobenzamide
CID 55359598
N-(2-benzylpyrazol-3-yl)-2-bromo-5-methoxybenzamide
CID 9116244
N-(2-benzylpyrazol-3-yl)-2-(oxolan-2-ylmethoxy)benzamide
CID 24535045
N-[2-[(4-chlorophenyl)methyl]pyrazol-3-yl]-2-ethoxybenzamide
CID 26725871
2-ethoxy-N-[2-[(5-methylfuran-2-yl)methyl]pyrazol-3-yl]pyridine-3-carboxamide
CID 8903088
(2S)-N-(2-benzylpyrazol-3-yl)-2-phenoxypropanamide
CID 30804831
N-(4-methoxyphenyl)-2-phenoxypyridine-3-carboxamide
CID 24513637
N-(2-benzylpyrazol-3-yl)-2-(4-chlorophenoxy)acetamide
CID 2542749
(1-benzyltetrazol-5-yl)methyl 2-phenoxypyridine-3-carboxylate
CID 31582800

Frequently Asked Questions

What is the IUPAC name of N-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide?
The IUPAC name of N-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide (CID 8890850) is N-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide.
What is the SMILES notation for N-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide?
The canonical SMILES for N-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide is O=C(Nc1ccnn1Cc1ccccc1)c1cccnc1Oc1ccccc1.
What is the InChIKey of N-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide?
The InChIKey is UKBKFIJVGOCISH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O2/c27-21(19-12-7-14-23-22(19)28-18-10-5-2-6-11-18)25-20-13-15-24-26(20)16-17-8-3-1-4-9-17/h1-15H,16H2,(H,25,27).
What are the key properties of N-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide?
N-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide has a molecular weight of 370.41 g/mol, XLogP of 4.37, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzylpyrazol-3-yl)-2-phenoxypyridine-3-carboxamide is sourced from PubChem (CID 8890850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).