N,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide

C19H28N4O — CID 60621587

IUPACN,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCCc1c(C(=O)N(CC)CC(CC)CC)cnn1-c1ccccn1
InChIInChI=1S/C19H28N4O/c1-5-15(6-2)14-22(8-4)19(24)16-13-21-23(17(16)7-3)18-11-9-10-12-20-18/h9-13,15H,5-8,14H2,1-4H3
InChIKeyCAZPXTULLWRUAD-UHFFFAOYSA-N
MW328.46 g/mol
LogP3.73
Rot. Bonds8

About N,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide

N,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide (PubChem CID 60621587) has the molecular formula C19H28N4O and a molecular weight of 328.46 g/mol. Its IUPAC name is N,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide
PubChem CID60621587
Molecular FormulaC19H28N4O
Molecular Weight328.46 g/mol
Exact Mass328.23
IUPAC NameN,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCCc1c(C(=O)N(CC)CC(CC)CC)cnn1-c1ccccn1
InChIInChI=1S/C19H28N4O/c1-5-15(6-2)14-22(8-4)19(24)16-13-21-23(17(16)7-3)18-11-9-10-12-20-18/h9-13,15H,5-8,14H2,1-4H3
InChIKeyCAZPXTULLWRUAD-UHFFFAOYSA-N
XLogP3.73
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.46
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-N-[3-(methylamino)propyl]-1-pyridin-2-ylpyrazole-4-carboxamide
CID 119433437
4-[(5-ethyl-1-pyridin-2-ylpyrazole-4-carbonyl)amino]butanoic acid
CID 119352538
N-[[2-[(dimethylamino)methyl]phenyl]methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 39043684
5-ethyl-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1-pyridin-2-ylpyrazole-4-carboxamide
CID 86853859
5-ethyl-N-(2-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
CID 15944173
2-bromo-N-ethyl-N-(2-ethylbutyl)pyridine-3-carboxamide
CID 103752405
N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 55831374
5-ethyl-N-[3-(4-ethylpiperazin-1-yl)propyl]-1-pyridin-2-ylpyrazole-4-carboxamide
CID 55660071
5-propyl-1-pyridin-2-ylpyrazole-4-carboxylic acid
CID 28606394
5-ethyl-N-(3-hydroxyphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
CID 91885720
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 87043673
N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-5-propan-2-yl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 55666540

Frequently Asked Questions

What is the IUPAC name of N,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide?
The IUPAC name of N,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide (CID 60621587) is N,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for N,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide?
The canonical SMILES for N,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide is CCc1c(C(=O)N(CC)CC(CC)CC)cnn1-c1ccccn1.
What is the InChIKey of N,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide?
The InChIKey is CAZPXTULLWRUAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O/c1-5-15(6-2)14-22(8-4)19(24)16-13-21-23(17(16)7-3)18-11-9-10-12-20-18/h9-13,15H,5-8,14H2,1-4H3.
What are the key properties of N,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide?
N,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide has a molecular weight of 328.46 g/mol, XLogP of 3.73, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-diethyl-N-(2-ethylbutyl)-1-pyridin-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 60621587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).