N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide

C15H19N3O2 — CID 115603580

IUPACN-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide
SMILESCC(C)(C)c1cc(NC(=O)Cc2cccc(O)c2)n[nH]1
InChIInChI=1S/C15H19N3O2/c1-15(2,3)12-9-13(18-17-12)16-14(20)8-10-5-4-6-11(19)7-10/h4-7,9,19H,8H2,1-3H3,(H2,16,17,18,20)
InChIKeyBVMLDYKLRCYHLM-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.59
Rot. Bonds3

About N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide

N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide (PubChem CID 115603580) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide
PubChem CID115603580
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide
SMILESCC(C)(C)c1cc(NC(=O)Cc2cccc(O)c2)n[nH]1
InChIInChI=1S/C15H19N3O2/c1-15(2,3)12-9-13(18-17-12)16-14(20)8-10-5-4-6-11(19)7-10/h4-7,9,19H,8H2,1-3H3,(H2,16,17,18,20)
InChIKeyBVMLDYKLRCYHLM-UHFFFAOYSA-N
XLogP2.59
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide
CID 47067672
2-(3-hydroxyphenyl)-N-(5-propan-2-yl-1H-pyrazol-3-yl)acetamide
CID 112688408
2-(4-bromophenyl)-N-(5-tert-butyl-1H-pyrazol-3-yl)acetamide
CID 115589896
N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide
CID 60551609
2-[2-(aminomethyl)phenyl]-N-(5-tert-butyl-1H-pyrazol-3-yl)acetamide
CID 104618499
N-(5-tert-butyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide
CID 104619985
3-(3-bromophenyl)-N-(5-tert-butyl-1H-pyrazol-3-yl)propanamide
CID 115589940
3-amino-N-(5-tert-butyl-1H-pyrazol-3-yl)-3-methylbutanamide
CID 113433629
N-(5-tert-butyl-1H-pyrazol-3-yl)-2-isoquinolin-4-ylacetamide
CID 166252631
N-(6-ethoxy-2-pyridinyl)-2-(3-hydroxyphenyl)acetamide
CID 71865850
2-acetamido-N-(5-tert-butyl-1H-pyrazol-3-yl)acetamide
CID 112686897
N-tert-butyl-2-(3-hydroxyphenyl)acetamide
CID 61399885

Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide?
The IUPAC name of N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide (CID 115603580) is N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide?
The canonical SMILES for N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide is CC(C)(C)c1cc(NC(=O)Cc2cccc(O)c2)n[nH]1.
What is the InChIKey of N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide?
The InChIKey is BVMLDYKLRCYHLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-15(2,3)12-9-13(18-17-12)16-14(20)8-10-5-4-6-11(19)7-10/h4-7,9,19H,8H2,1-3H3,(H2,16,17,18,20).
What are the key properties of N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide?
N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide has a molecular weight of 273.34 g/mol, XLogP of 2.59, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butyl-1H-pyrazol-3-yl)-2-(3-hydroxyphenyl)acetamide is sourced from PubChem (CID 115603580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).