4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide

C13H15N5O2 — CID 115593799

IUPAC4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide
SMILESCCc1cc(NC(=O)c2ccc(NC(N)=O)cc2)n[nH]1
InChIInChI=1S/C13H15N5O2/c1-2-9-7-11(18-17-9)16-12(19)8-3-5-10(6-4-8)15-13(14)20/h3-7H,2H2,1H3,(H3,14,15,20)(H2,16,17,18,19)
InChIKeyHYZPFBNERSLKKO-UHFFFAOYSA-N
MW273.30 g/mol
LogP1.72
Rot. Bonds4

About 4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide

4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide (PubChem CID 115593799) has the molecular formula C13H15N5O2 and a molecular weight of 273.30 g/mol. Its IUPAC name is 4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide.

Molecular Properties

Compound Name4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide
PubChem CID115593799
Molecular FormulaC13H15N5O2
Molecular Weight273.30 g/mol
Exact Mass273.12
IUPAC Name4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide
SMILESCCc1cc(NC(=O)c2ccc(NC(N)=O)cc2)n[nH]1
InChIInChI=1S/C13H15N5O2/c1-2-9-7-11(18-17-9)16-12(19)8-3-5-10(6-4-8)15-13(14)20/h3-7H,2H2,1H3,(H3,14,15,20)(H2,16,17,18,19)
InChIKeyHYZPFBNERSLKKO-UHFFFAOYSA-N
XLogP1.72
TPSA112.90 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 51.72
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Related Compounds

(5-ethyl-1H-pyrazol-3-yl)urea
CID 104620406
4-(dimethylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide
CID 47423237
4-(carbamoylamino)-N-(5-propan-2-yl-1H-pyrazol-3-yl)benzamide
CID 115592993
3-[[4-(carbamoylamino)benzoyl]amino]-1H-pyrazole-5-carboxylic acid
CID 64528846
N-(5-ethyl-1H-pyrazol-3-yl)-4-(methoxymethyl)benzamide
CID 47423292
N-(5-ethyl-1H-pyrazol-3-yl)quinoxaline-6-carboxamide
CID 115884080
3-amino-N-(5-ethyl-1H-pyrazol-3-yl)benzamide
CID 113433320
4-[ethyl(propan-2-yl)amino]-N-(5-ethyl-1H-pyrazol-3-yl)benzamide
CID 86875491
3-amino-4-ethoxy-N-(5-ethyl-1H-pyrazol-3-yl)benzamide
CID 104616103
3-bromo-N-(5-ethyl-1H-pyrazol-3-yl)benzamide
CID 47423213
3-chloro-N-(5-ethyl-1H-pyrazol-3-yl)-4-fluorobenzamide
CID 113263522
1-(5-ethyl-1H-pyrazol-3-yl)-3-(4-methylphenyl)urea
CID 104620407

Frequently Asked Questions

What is the IUPAC name of 4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide?
The IUPAC name of 4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide (CID 115593799) is 4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide.
What is the SMILES notation for 4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide?
The canonical SMILES for 4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide is CCc1cc(NC(=O)c2ccc(NC(N)=O)cc2)n[nH]1.
What is the InChIKey of 4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide?
The InChIKey is HYZPFBNERSLKKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O2/c1-2-9-7-11(18-17-9)16-12(19)8-3-5-10(6-4-8)15-13(14)20/h3-7H,2H2,1H3,(H3,14,15,20)(H2,16,17,18,19).
What are the key properties of 4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide?
4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide has a molecular weight of 273.30 g/mol, XLogP of 1.72, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide is sourced from PubChem (CID 115593799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).