4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide

C16H22N4O — CID 65357426

IUPAC4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1c(N)cnn1CC
InChIInChI=1S/C16H22N4O/c1-4-11-8-7-9-12(5-2)14(11)19-16(21)15-13(17)10-18-20(15)6-3/h7-10H,4-6,17H2,1-3H3,(H,19,21)
InChIKeyLZVGFZPTJQOMFQ-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.86
Rot. Bonds5

About 4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide

4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide (PubChem CID 65357426) has the molecular formula C16H22N4O and a molecular weight of 286.38 g/mol. Its IUPAC name is 4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide
PubChem CID65357426
Molecular FormulaC16H22N4O
Molecular Weight286.38 g/mol
Exact Mass286.18
IUPAC Name4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1c(N)cnn1CC
InChIInChI=1S/C16H22N4O/c1-4-11-8-7-9-12(5-2)14(11)19-16(21)15-13(17)10-18-20(15)6-3/h7-10H,4-6,17H2,1-3H3,(H,19,21)
InChIKeyLZVGFZPTJQOMFQ-UHFFFAOYSA-N
XLogP2.86
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-1-ethyl-N-pyridin-4-ylpyrazole-5-carboxamide
CID 65357225
4-amino-N-(4-chlorophenyl)-1-ethylpyrazole-5-carboxamide
CID 65357708
N-(4-acetylphenyl)-4-amino-1-ethylpyrazole-5-carboxamide
CID 65357059
4-amino-N-(4-cyanophenyl)-1-ethylpyrazole-5-carboxamide
CID 65357180
4-amino-N-(2-cyano-3-methylphenyl)-1-ethylpyrazole-5-carboxamide
CID 107802362
4-amino-1-ethyl-N-(1H-pyrazol-4-yl)pyrazole-5-carboxamide
CID 65357048
4-amino-N-(1,3-benzodioxol-5-yl)-1-ethylpyrazole-5-carboxamide
CID 65356994
4-amino-1-ethyl-N-(1,3-thiazol-2-yl)pyrazole-5-carboxamide
CID 65357658
methyl 3-[(4-amino-1-ethylpyrazole-5-carbonyl)amino]-4-methylthiophene-2-carboxylate
CID 114914522
4-amino-N-[4-(cyanomethyl)phenyl]-1-ethylpyrazole-5-carboxamide
CID 65359105
4-amino-N-cyclopropyl-1-ethylpyrazole-5-carboxamide
CID 65356982
4-amino-N-(4-bromo-2-methoxy-6-methylphenyl)-1-ethylpyrazole-5-carboxamide
CID 65357007

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide?
The IUPAC name of 4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide (CID 65357426) is 4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide?
The canonical SMILES for 4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide is CCc1cccc(CC)c1NC(=O)c1c(N)cnn1CC.
What is the InChIKey of 4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide?
The InChIKey is LZVGFZPTJQOMFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O/c1-4-11-8-7-9-12(5-2)14(11)19-16(21)15-13(17)10-18-20(15)6-3/h7-10H,4-6,17H2,1-3H3,(H,19,21).
What are the key properties of 4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide?
4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide has a molecular weight of 286.38 g/mol, XLogP of 2.86, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,6-diethylphenyl)-1-ethylpyrazole-5-carboxamide is sourced from PubChem (CID 65357426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).