N-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide

C15H22N6O2 — CID 19398373

IUPACN-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide
SMILESCCCNC(=O)c1nn(CC)cc1NC(=O)c1cn(C)nc1C
InChIInChI=1S/C15H22N6O2/c1-5-7-16-15(23)13-12(9-21(6-2)19-13)17-14(22)11-8-20(4)18-10(11)3/h8-9H,5-7H2,1-4H3,(H,16,23)(H,17,22)
InChIKeyQIZOODPXMIPLCL-UHFFFAOYSA-N
MW318.38 g/mol
LogP1.34
Rot. Bonds6

About N-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide

N-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide (PubChem CID 19398373) has the molecular formula C15H22N6O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is N-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide
PubChem CID19398373
Molecular FormulaC15H22N6O2
Molecular Weight318.38 g/mol
Exact Mass318.18
IUPAC NameN-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide
SMILESCCCNC(=O)c1nn(CC)cc1NC(=O)c1cn(C)nc1C
InChIInChI=1S/C15H22N6O2/c1-5-7-16-15(23)13-12(9-21(6-2)19-13)17-14(22)11-8-20(4)18-10(11)3/h8-9H,5-7H2,1-4H3,(H,16,23)(H,17,22)
InChIKeyQIZOODPXMIPLCL-UHFFFAOYSA-N
XLogP1.34
TPSA93.84 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-methyl-N-[(1-methyl-1H-pyrazol-5-yl)methyl]-1H-pyrazole-5-carboxamide
CID 844027
4-amino-1-methyl-1H-pyrazole-3-carboxamide
CID 6485351
4-(azetidine-1-carbonyl)-N-[1-ethyl-5-(2-methylpropylcarbamoyl)pyrazol-4-yl]-1-methylpyrazole-5-carboxamide
CID 165415390
4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(2-methylpropylcarbamoyl)pyrazol-4-yl]pyrazole-5-carboxamide
CID 165415399
1-ethyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1H-pyrazole-3-carboxamide
CID 6469837
N-[(1,5-dimethylpyrazol-4-yl)methyl]-2-methyl-4-nitropyrazole-3-carboxamide
CID 698777
Pyrazole-3,4-dicarboxamide, N,N',1-trimethyl-
CID 210532
Etipirol
CID 166751
4-amino-N,1-dimethyl-1H-pyrazole-5-carboxamide
CID 6485370
4-(azetidine-1-carbonyl)-1-methyl-N-[1-methyl-5-(piperidine-1-carbonyl)pyrazol-4-yl]pyrazole-5-carboxamide
CID 165415372
4-(azetidine-1-carbonyl)-N-[1-ethyl-5-(ethylcarbamoyl)pyrazol-4-yl]-1-methylpyrazole-5-carboxamide
CID 165415406
4-(azetidine-1-carbonyl)-N-[5-(ethylcarbamoyl)-1-methylpyrazol-4-yl]-1-methylpyrazole-5-carboxamide
CID 165415434

Frequently Asked Questions

What is the IUPAC name of N-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide?
The IUPAC name of N-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide (CID 19398373) is N-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide.
What is the SMILES notation for N-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide?
The canonical SMILES for N-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide is CCCNC(=O)c1nn(CC)cc1NC(=O)c1cn(C)nc1C.
What is the InChIKey of N-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide?
The InChIKey is QIZOODPXMIPLCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N6O2/c1-5-7-16-15(23)13-12(9-21(6-2)19-13)17-14(22)11-8-20(4)18-10(11)3/h8-9H,5-7H2,1-4H3,(H,16,23)(H,17,22).
What are the key properties of N-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide?
N-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide has a molecular weight of 318.38 g/mol, XLogP of 1.34, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-ethyl-3-(propylcarbamoyl)pyrazol-4-yl]-1,3-dimethylpyrazole-4-carboxamide is sourced from PubChem (CID 19398373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).