N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide

C13H16N4O — CID 47423313

IUPACN-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide
SMILESCCc1cc(NC(=O)CCc2cccnc2)n[nH]1
InChIInChI=1S/C13H16N4O/c1-2-11-8-12(17-16-11)15-13(18)6-5-10-4-3-7-14-9-10/h3-4,7-9H,2,5-6H2,1H3,(H2,15,16,17,18)
InChIKeyZLBLCPGRHLZSGB-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.94
Rot. Bonds5

About N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide

N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide (PubChem CID 47423313) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide
PubChem CID47423313
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC NameN-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide
SMILESCCc1cc(NC(=O)CCc2cccnc2)n[nH]1
InChIInChI=1S/C13H16N4O/c1-2-11-8-12(17-16-11)15-13(18)6-5-10-4-3-7-14-9-10/h3-4,7-9H,2,5-6H2,1H3,(H2,15,16,17,18)
InChIKeyZLBLCPGRHLZSGB-UHFFFAOYSA-N
XLogP1.94
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-ethylphenyl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 47215997
3-pyridin-3-yl-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)propanamide
CID 82133863
N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-phenylethylsulfanyl)acetamide
CID 48507728
N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide
CID 110865452
N-(5-fluoro-2-methylphenyl)-3-pyridin-3-ylpropanamide
CID 9208566
N-[5-[(dimethylamino)methyl]-1H-pyrazol-3-yl]-3-phenylpropanamide
CID 95755349
N-ethoxy-3-pyridin-3-ylpropanamide
CID 60717875
N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide
CID 47423285
N-(5-ethyl-1H-pyrazol-3-yl)-3-methylsulfanylpropanamide
CID 115593810
N-(5-ethyl-1H-pyrazol-3-yl)-3-phenylsulfanylpropanamide
CID 104619671
N-(3-acetylphenyl)-3-pyridin-3-ylpropanamide
CID 9209643
4-amino-N-(5-ethyl-1H-pyrazol-3-yl)pentanamide
CID 104617963

Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide?
The IUPAC name of N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide (CID 47423313) is N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide is CCc1cc(NC(=O)CCc2cccnc2)n[nH]1.
What is the InChIKey of N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide?
The InChIKey is ZLBLCPGRHLZSGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-2-11-8-12(17-16-11)15-13(18)6-5-10-4-3-7-14-9-10/h3-4,7-9H,2,5-6H2,1H3,(H2,15,16,17,18).
What are the key properties of N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide?
N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide has a molecular weight of 244.30 g/mol, XLogP of 1.94, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1H-pyrazol-3-yl)-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 47423313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).