2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide

C13H23N3O — CID 1219937

IUPAC2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide
SMILESCCCc1nn(CC(N)=O)c(CCC)c1CC
InChIInChI=1S/C13H23N3O/c1-4-7-11-10(6-3)12(8-5-2)16(15-11)9-13(14)17/h4-9H2,1-3H3,(H2,14,17)
InChIKeyWWVLZKDMEOIWEG-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.84
Rot. Bonds7

About 2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide

2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide (PubChem CID 1219937) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide.

Molecular Properties

Compound Name2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide
PubChem CID1219937
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide
SMILESCCCc1nn(CC(N)=O)c(CCC)c1CC
InChIInChI=1S/C13H23N3O/c1-4-7-11-10(6-3)12(8-5-2)16(15-11)9-13(14)17/h4-9H2,1-3H3,(H2,14,17)
InChIKeyWWVLZKDMEOIWEG-UHFFFAOYSA-N
XLogP1.84
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]acetamide
CID 788042
N-isobutyl-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]acetamide
CID 798599
N-propyl-2-[3-(trifluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]acetamide
CID 3136371
N-butan-2-yl-2-[3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-1-yl]acetamide
CID 3136372
N-Isopropyl-2-(3-trifluoromethyl-5,6-dihydro-4H-cyclopentapyrazol-1-yl)-acetamide
CID 1129760
N-Cyclopentyl-2-(3-trifluoromethyl-4,5,6,7-tetrahydro-indazol-1-yl)-acetamide
CID 650832
N-sec-Butyl-2-(3-trifluoromethyl-4,5,6,7-tetrahydro-indazol-1-yl)-acetamide
CID 3136365
3-(trimethyl-1H-pyrazol-4-yl)propan-1-amine
CID 6492154
N-propyl-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]acetamide
CID 2056737
N-(tert-butyl)-2-[3-(trifluoromethyl)(1H-4,5,6,7-tetrahydroindazolyl)]acetamid e
CID 3136366
N-(1,3,5-trimethylpyrazol-4-yl)-2-[2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]acetamide
CID 56780695
N-(dicyclopropylmethyl)-2-[2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidin-1-yl]acetamide
CID 56780711

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide?
The IUPAC name of 2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide (CID 1219937) is 2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide.
What is the SMILES notation for 2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide?
The canonical SMILES for 2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide is CCCc1nn(CC(N)=O)c(CCC)c1CC.
What is the InChIKey of 2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide?
The InChIKey is WWVLZKDMEOIWEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-4-7-11-10(6-3)12(8-5-2)16(15-11)9-13(14)17/h4-9H2,1-3H3,(H2,14,17).
What are the key properties of 2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide?
2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide has a molecular weight of 237.35 g/mol, XLogP of 1.84, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-3,5-dipropylpyrazol-1-yl)acetamide is sourced from PubChem (CID 1219937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).