3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide

C14H18N4O — CID 104618025

IUPAC3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide
SMILESCCc1cc(NC(=O)C(CN)c2ccccc2)n[nH]1
InChIInChI=1S/C14H18N4O/c1-2-11-8-13(18-17-11)16-14(19)12(9-15)10-6-4-3-5-7-10/h3-8,12H,2,9,15H2,1H3,(H2,16,17,18,19)
InChIKeyQWOFUGOCKSCDJL-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.65
Rot. Bonds5

About 3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide

3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide (PubChem CID 104618025) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide
PubChem CID104618025
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide
SMILESCCc1cc(NC(=O)C(CN)c2ccccc2)n[nH]1
InChIInChI=1S/C14H18N4O/c1-2-11-8-13(18-17-11)16-14(19)12(9-15)10-6-4-3-5-7-10/h3-8,12H,2,9,15H2,1H3,(H2,16,17,18,19)
InChIKeyQWOFUGOCKSCDJL-UHFFFAOYSA-N
XLogP1.65
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-(5-ethyl-1H-pyrazol-3-yl)butanamide
CID 104617946
3-amino-N-(2-ethylphenyl)-2-phenylpropanamide
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N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-hydroxyphenyl)acetamide
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(5-ethyl-1H-pyrazol-3-yl)urea
CID 104620406
3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-phenylpropanamide
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N-(5-ethyl-1H-pyrazol-3-yl)-3-phenylsulfanylpropanamide
CID 104619671
3-amino-N-(4,6-dimethylpyrimidin-2-yl)-2-phenylpropanamide
CID 62878158
3-amino-3-phenyl-N-(5-propyl-1H-pyrazol-3-yl)propanamide
CID 104618213
2-(4-chlorophenyl)-N-(5-ethyl-1H-pyrazol-3-yl)-3-methylbutanamide
CID 115609317
(2S)-2-amino-N-(5-ethyl-1H-pyrazol-3-yl)-3-(4-hydroxyphenyl)propanamide
CID 104618065
2-(benzimidazol-1-yl)-N-(5-ethyl-1H-pyrazol-3-yl)propanamide
CID 48507866
(2S)-2-amino-N-(5-ethyl-1H-pyrazol-3-yl)-4-methylsulfanylbutanamide
CID 103950165

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide?
The IUPAC name of 3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide (CID 104618025) is 3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide.
What is the SMILES notation for 3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide?
The canonical SMILES for 3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide is CCc1cc(NC(=O)C(CN)c2ccccc2)n[nH]1.
What is the InChIKey of 3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide?
The InChIKey is QWOFUGOCKSCDJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-2-11-8-13(18-17-11)16-14(19)12(9-15)10-6-4-3-5-7-10/h3-8,12H,2,9,15H2,1H3,(H2,16,17,18,19).
What are the key properties of 3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide?
3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide has a molecular weight of 258.32 g/mol, XLogP of 1.65, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(5-ethyl-1H-pyrazol-3-yl)-2-phenylpropanamide is sourced from PubChem (CID 104618025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).