4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide

C15H18N4O2 — CID 19410625

IUPAC4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide
SMILESCCc1ccc(C(=O)Nc2cn(C)nc2C(=O)NC)cc1
InChIInChI=1S/C15H18N4O2/c1-4-10-5-7-11(8-6-10)14(20)17-12-9-19(3)18-13(12)15(21)16-2/h5-9H,4H2,1-3H3,(H,16,21)(H,17,20)
InChIKeyYHXWNTJOEHPPQP-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.59
Rot. Bonds4

About 4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide

4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide (PubChem CID 19410625) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide
PubChem CID19410625
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide
SMILESCCc1ccc(C(=O)Nc2cn(C)nc2C(=O)NC)cc1
InChIInChI=1S/C15H18N4O2/c1-4-10-5-7-11(8-6-10)14(20)17-12-9-19(3)18-13(12)15(21)16-2/h5-9H,4H2,1-3H3,(H,16,21)(H,17,20)
InChIKeyYHXWNTJOEHPPQP-UHFFFAOYSA-N
XLogP1.59
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[4-[(4-chlorophenoxy)methyl]benzoyl]amino]-N,1-dimethylpyrazole-3-carboxamide
CID 19410621
N,1-dimethyl-4-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]pyrazole-3-carboxamide
CID 19408910
4-[(2-chloroacetyl)amino]-N,1-dimethylpyrazole-3-carboxamide
CID 19410660
N,1-dimethyl-4-[[2-(4-methylbenzoyl)benzoyl]amino]pyrazole-3-carboxamide
CID 19410634
4-[[4-[(3,5-dimethylpyrazol-1-yl)methyl]benzoyl]amino]-1-ethyl-N-methylpyrazole-3-carboxamide
CID 19410856
N,1-dimethyl-4-[[5-(pyrazol-1-ylmethyl)furan-2-carbonyl]amino]pyrazole-3-carboxamide
CID 19408956
1-ethyl-4-[(4-ethylbenzoyl)amino]-N-phenylpyrazole-3-carboxamide
CID 19404758
N-(4-cyano-1-methylpyrazol-3-yl)-4-ethylbenzamide
CID 115672371
1-ethyl-3,5-dimethyl-N-[1-methyl-3-(methylcarbamoyl)pyrazol-4-yl]pyrazole-4-carboxamide
CID 19472242
4-amino-N-(3-ethyl-1-methylpyrazol-4-yl)benzamide
CID 113369006
4-(aminomethyl)-N-(1,3-dimethylpyrazol-4-yl)benzamide
CID 103796977
4-[[3-[(4-bromophenoxy)methyl]benzoyl]amino]-N,1-dimethylpyrazole-3-carboxamide
CID 19408944

Frequently Asked Questions

What is the IUPAC name of 4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide?
The IUPAC name of 4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide (CID 19410625) is 4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide.
What is the SMILES notation for 4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide?
The canonical SMILES for 4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide is CCc1ccc(C(=O)Nc2cn(C)nc2C(=O)NC)cc1.
What is the InChIKey of 4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide?
The InChIKey is YHXWNTJOEHPPQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-4-10-5-7-11(8-6-10)14(20)17-12-9-19(3)18-13(12)15(21)16-2/h5-9H,4H2,1-3H3,(H,16,21)(H,17,20).
What are the key properties of 4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide?
4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide has a molecular weight of 286.34 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-ethylbenzoyl)amino]-N,1-dimethylpyrazole-3-carboxamide is sourced from PubChem (CID 19410625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).