N-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide

C17H23N3O — CID 104620220

IUPACN-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide
SMILESCCc1cn[nH]c1NC(=O)C(c1ccccc1)C(C)CC
InChIInChI=1S/C17H23N3O/c1-4-12(3)15(14-9-7-6-8-10-14)17(21)19-16-13(5-2)11-18-20-16/h6-12,15H,4-5H2,1-3H3,(H2,18,19,20,21)
InChIKeyGQTBUEZEPMDGFF-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.74
Rot. Bonds6

About N-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide

N-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide (PubChem CID 104620220) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is N-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide.

Molecular Properties

Compound NameN-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide
PubChem CID104620220
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC NameN-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide
SMILESCCc1cn[nH]c1NC(=O)C(c1ccccc1)C(C)CC
InChIInChI=1S/C17H23N3O/c1-4-12(3)15(14-9-7-6-8-10-14)17(21)19-16-13(5-2)11-18-20-16/h6-12,15H,4-5H2,1-3H3,(H2,18,19,20,21)
InChIKeyGQTBUEZEPMDGFF-UHFFFAOYSA-N
XLogP3.74
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(4-ethyl-1H-pyrazol-5-yl)-3-phenylpropanamide
CID 104619330
(2R,3R)-3-methyl-2-phenyl-N-(1,3-thiazol-2-yl)pentanamide
CID 8762760
3-methyl-2-phenyl-N-(1H-pyrazol-4-ylmethyl)pentanamide
CID 60999920
(2S,3R)-N-(2,5-dimethylphenyl)-3-methyl-2-phenylpentanamide
CID 8712534
N-[5-[(2-methoxyphenyl)methyl]-1,3-thiazol-2-yl]-3-methyl-2-phenylpentanamide
CID 58033028
(2R)-N-(4-ethyl-1H-pyrazol-5-yl)-2-(4-methylphenoxy)propanamide
CID 95973797
(2R,3S)-N-[4-(2-amino-2-oxoethyl)phenyl]-3-methyl-2-phenylpentanamide
CID 95310454
3-methyl-N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-2-phenylpentanamide
CID 55765150
N-(1,3-dihydroxypropan-2-yl)-3-methyl-2-phenylpentanamide
CID 65315116
N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methylphenyl)acetamide
CID 113251561
(2S,3R)-N-(2,3-dimethylphenyl)-3-methyl-2-phenylpentanamide
CID 8714216
1-(4-ethyl-1H-pyrazol-5-yl)-3-(2-methoxyphenyl)urea
CID 104620572

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide?
The IUPAC name of N-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide (CID 104620220) is N-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide.
What is the SMILES notation for N-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide?
The canonical SMILES for N-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide is CCc1cn[nH]c1NC(=O)C(c1ccccc1)C(C)CC.
What is the InChIKey of N-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide?
The InChIKey is GQTBUEZEPMDGFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-4-12(3)15(14-9-7-6-8-10-14)17(21)19-16-13(5-2)11-18-20-16/h6-12,15H,4-5H2,1-3H3,(H2,18,19,20,21).
What are the key properties of N-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide?
N-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide has a molecular weight of 285.39 g/mol, XLogP of 3.74, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-1H-pyrazol-5-yl)-3-methyl-2-phenylpentanamide is sourced from PubChem (CID 104620220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).