2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide

C16H21N3O — CID 110858132

IUPAC2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide
SMILESCc1cc(CC(=O)Nc2ccc(C(C)C)cc2)n(C)n1
InChIInChI=1S/C16H21N3O/c1-11(2)13-5-7-14(8-6-13)17-16(20)10-15-9-12(3)18-19(15)4/h5-9,11H,10H2,1-4H3,(H,17,20)
InChIKeyRYQIIWQHCQJMGG-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.03
Rot. Bonds4

About 2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide

2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide (PubChem CID 110858132) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide
PubChem CID110858132
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide
SMILESCc1cc(CC(=O)Nc2ccc(C(C)C)cc2)n(C)n1
InChIInChI=1S/C16H21N3O/c1-11(2)13-5-7-14(8-6-13)17-16(20)10-15-9-12(3)18-19(15)4/h5-9,11H,10H2,1-4H3,(H,17,20)
InChIKeyRYQIIWQHCQJMGG-UHFFFAOYSA-N
XLogP3.03
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chlorophenyl)-2-(2,5-dimethylpyrazol-3-yl)acetamide
CID 110858844
2-(2,5-dimethylpyrazol-3-yl)-N-propan-2-ylacetamide
CID 110847891
2-(2,5-dimethylpyrazol-3-yl)-N-methylacetamide
CID 167145716
2-(3,4-dichlorophenyl)-N-(4-propan-2-ylphenyl)acetamide
CID 7957082
2-(methylamino)-N-(4-propan-2-ylphenyl)acetamide;hydrochloride
CID 119672801
2-(1-methylimidazol-2-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 110474647
(2R)-2-[[2-(2,5-dimethylpyrazol-3-yl)acetyl]amino]-4-methylpentanoic acid
CID 110836656
2-(4-propan-2-ylanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 39448754
1-(2-ethyl-5-methylpyrazol-3-yl)-3-(4-propan-2-ylphenyl)urea
CID 35766434
2-iodo-N-(4-propan-2-ylphenyl)acetamide
CID 60723215
2-(4-hydroxyphenyl)-N-(4-propan-2-ylphenyl)acetamide
CID 14879850
2-[[2-(2,5-dimethylpyrazol-3-yl)acetyl]amino]-2-methylpropanoic acid
CID 110836652

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide (CID 110858132) is 2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide is Cc1cc(CC(=O)Nc2ccc(C(C)C)cc2)n(C)n1.
What is the InChIKey of 2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide?
The InChIKey is RYQIIWQHCQJMGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-11(2)13-5-7-14(8-6-13)17-16(20)10-15-9-12(3)18-19(15)4/h5-9,11H,10H2,1-4H3,(H,17,20).
What are the key properties of 2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide?
2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide has a molecular weight of 271.36 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylpyrazol-3-yl)-N-(4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 110858132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).