N-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide

C17H19N5O2 — CID 100830430

IUPACN-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide
SMILESCCn1nc(NC(=O)c2cc(OC)nn2-c2ccccc2)cc1C
InChIInChI=1S/C17H19N5O2/c1-4-21-12(2)10-15(19-21)18-17(23)14-11-16(24-3)20-22(14)13-8-6-5-7-9-13/h5-11H,4H2,1-3H3,(H,18,19,23)
InChIKeyZAHJXIHHKUQMNT-UHFFFAOYSA-N
MW325.37 g/mol
LogP2.66
Rot. Bonds5

About N-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide

N-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide (PubChem CID 100830430) has the molecular formula C17H19N5O2 and a molecular weight of 325.37 g/mol. Its IUPAC name is N-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide.

Molecular Properties

Compound NameN-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide
PubChem CID100830430
Molecular FormulaC17H19N5O2
Molecular Weight325.37 g/mol
Exact Mass325.15
IUPAC NameN-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide
SMILESCCn1nc(NC(=O)c2cc(OC)nn2-c2ccccc2)cc1C
InChIInChI=1S/C17H19N5O2/c1-4-21-12(2)10-15(19-21)18-17(23)14-11-16(24-3)20-22(14)13-8-6-5-7-9-13/h5-11H,4H2,1-3H3,(H,18,19,23)
InChIKeyZAHJXIHHKUQMNT-UHFFFAOYSA-N
XLogP2.66
TPSA73.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-3-methoxy-1-phenylpyrazole-5-carboxamide
CID 100830947
3-methoxy-N-[(1-methylpyrazol-3-yl)methyl]-1-phenylpyrazole-5-carboxamide
CID 100830431
3-methoxy-1-phenyl-N-(pyridin-3-ylmethyl)pyrazole-5-carboxamide
CID 100830411
3-N,5-N-bis(1-ethyl-5-methylpyrazol-3-yl)-1-methylpyrazole-3,5-dicarboxamide
CID 29097386
3-methoxy-1-(4-methylphenyl)pyrazole-5-carboxylic acid
CID 83864128
(2S)-2-(4-bromo-1-phenylpyrazol-3-yl)oxy-N-(1-ethyl-5-methylpyrazol-3-yl)propanamide
CID 100830119
(2R)-2-(4-bromo-1-phenylpyrazol-3-yl)oxy-N-(1-ethyl-5-methylpyrazol-3-yl)propanamide
CID 100830118
5-ethyl-N-(1-ethyl-5-methylpyrazol-3-yl)thiophene-3-carboxamide
CID 19617153
N-(4-methoxyphenyl)-1,3-diphenylpyrazole-5-carboxamide
CID 7900022
N-(6-methoxy-3-pyridinyl)-1-phenyl-3-propan-2-ylpyrazole-5-carboxamide
CID 56762146
N-(4-ethoxyphenyl)-5-methyl-2-phenylpyrazole-3-carboxamide
CID 110685989
4-tert-butyl-N-(5-methyl-1-phenylpyrazol-3-yl)benzamide
CID 46107065

Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide?
The IUPAC name of N-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide (CID 100830430) is N-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide.
What is the SMILES notation for N-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide?
The canonical SMILES for N-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide is CCn1nc(NC(=O)c2cc(OC)nn2-c2ccccc2)cc1C.
What is the InChIKey of N-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide?
The InChIKey is ZAHJXIHHKUQMNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O2/c1-4-21-12(2)10-15(19-21)18-17(23)14-11-16(24-3)20-22(14)13-8-6-5-7-9-13/h5-11H,4H2,1-3H3,(H,18,19,23).
What are the key properties of N-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide?
N-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide has a molecular weight of 325.37 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-5-methylpyrazol-3-yl)-3-methoxy-1-phenylpyrazole-5-carboxamide is sourced from PubChem (CID 100830430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).