1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea

C13H16N4O2 — CID 104620572

IUPAC1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea
SMILESCCc1cn[nH]c1NC(=O)Nc1ccccc1OC
InChIInChI=1S/C13H16N4O2/c1-3-9-8-14-17-12(9)16-13(18)15-10-6-4-5-7-11(10)19-2/h4-8H,3H2,1-2H3,(H3,14,15,16,17,18)
InChIKeyAPEPSLBTVSGXQV-UHFFFAOYSA-N
MW260.30 g/mol
LogP2.62
Rot. Bonds4

About 1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea

1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea (PubChem CID 104620572) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea.

Molecular Properties

Compound Name1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea
PubChem CID104620572
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea
SMILESCCc1cn[nH]c1NC(=O)Nc1ccccc1OC
InChIInChI=1S/C13H16N4O2/c1-3-9-8-14-17-12(9)16-13(18)15-10-6-4-5-7-11(10)19-2/h4-8H,3H2,1-2H3,(H3,14,15,16,17,18)
InChIKeyAPEPSLBTVSGXQV-UHFFFAOYSA-N
XLogP2.62
TPSA79.04 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 52.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methoxyphenyl)acetamide
CID 112697113
2-[2-[(4-methoxy-1H-pyrazol-5-yl)carbamoylamino]phenyl]-N-methylacetamide
CID 166329274
1-(2-methoxyphenyl)-3-(2-methoxypyrimidin-5-yl)urea
CID 71799842
1-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-(2-methoxyphenyl)urea
CID 881043
1-(4-ethyl-1,3-benzothiazol-2-yl)-3-(2-methoxyphenyl)urea
CID 121080923
N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methylphenyl)acetamide
CID 113251561
N-(4-ethyl-1H-pyrazol-5-yl)-3-methoxy-4-methylbenzamide
CID 115680812
1-(2-methoxyphenyl)-3-[(1R)-1-(1H-1,2,4-triazol-5-yl)ethyl]urea
CID 97158674
5-amino-N-(4-ethyl-1H-pyrazol-5-yl)-2-methoxybenzamide
CID 104616600
N-[(5-tert-butyl-1H-pyrazol-4-yl)methyl]-2-methoxyaniline
CID 68723027
3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide
CID 109037115
N-(2-ethylphenyl)-2-[4-[2-(2-methoxyanilino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 9436558

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea?
The IUPAC name of 1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea (CID 104620572) is 1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea.
What is the SMILES notation for 1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea?
The canonical SMILES for 1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea is CCc1cn[nH]c1NC(=O)Nc1ccccc1OC.
What is the InChIKey of 1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea?
The InChIKey is APEPSLBTVSGXQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-3-9-8-14-17-12(9)16-13(18)15-10-6-4-5-7-11(10)19-2/h4-8H,3H2,1-2H3,(H3,14,15,16,17,18).
What are the key properties of 1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea?
1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea has a molecular weight of 260.30 g/mol, XLogP of 2.62, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea is sourced from PubChem (CID 104620572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).