3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide

C15H23N5O — CID 71688992

IUPAC3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide
SMILESCCn1cc(NC(=O)CCc2c(C)nn(CC)c2C)cn1
InChIInChI=1S/C15H23N5O/c1-5-19-10-13(9-16-19)17-15(21)8-7-14-11(3)18-20(6-2)12(14)4/h9-10H,5-8H2,1-4H3,(H,17,21)
InChIKeyUASSGHSMGGSEES-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.31
Rot. Bonds6

About 3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide

3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide (PubChem CID 71688992) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is 3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide.

Molecular Properties

Compound Name3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide
PubChem CID71688992
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide
SMILESCCn1cc(NC(=O)CCc2c(C)nn(CC)c2C)cn1
InChIInChI=1S/C15H23N5O/c1-5-19-10-13(9-16-19)17-15(21)8-7-14-11(3)18-20(6-2)12(14)4/h9-10H,5-8H2,1-4H3,(H,17,21)
InChIKeyUASSGHSMGGSEES-UHFFFAOYSA-N
XLogP2.31
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 63309396
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CID 71689014
2-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-[1-[(1-ethylpyrazol-4-yl)methyl]pyrazol-4-yl]acetamide
CID 19525377
N-(1-ethylpyrazol-4-yl)-2-(prop-2-enylamino)acetamide
CID 79285076
1-ethyl-3-(1-ethylpyrazol-4-yl)urea
CID 115581870
2-(3-amino-1,2,4-triazol-1-yl)-N-(1-ethylpyrazol-4-yl)acetamide
CID 54901711
1-butyl-3-(1-ethylpyrazol-4-yl)urea
CID 47200322
N-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-1-ethyl-3,5-dimethylpyrazole-4-carboxamide
CID 19471999
3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-(3,5-dimethylphenyl)propanamide
CID 31405262
3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(oxolan-2-ylmethyl)propanamide
CID 71689007
3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(2-morpholin-4-ylethyl)propanamide
CID 71689005
3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]propanamide
CID 91947688

Frequently Asked Questions

What is the IUPAC name of 3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide?
The IUPAC name of 3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide (CID 71688992) is 3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide.
What is the SMILES notation for 3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide?
The canonical SMILES for 3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide is CCn1cc(NC(=O)CCc2c(C)nn(CC)c2C)cn1.
What is the InChIKey of 3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide?
The InChIKey is UASSGHSMGGSEES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-5-19-10-13(9-16-19)17-15(21)8-7-14-11(3)18-20(6-2)12(14)4/h9-10H,5-8H2,1-4H3,(H,17,21).
What are the key properties of 3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide?
3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide has a molecular weight of 289.38 g/mol, XLogP of 2.31, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-N-(1-ethylpyrazol-4-yl)propanamide is sourced from PubChem (CID 71688992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).