N-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide

C10H17N3O — CID 6621900

IUPACN-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide
SMILESCC(=O)Nc1cc(C)nn1C(C)(C)C
InChIInChI=1S/C10H17N3O/c1-7-6-9(11-8(2)14)13(12-7)10(3,4)5/h6H,1-5H3,(H,11,14)
InChIKeyCTTSVGPBSBJILG-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.90
Rot. Bonds1

About N-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide

N-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide (PubChem CID 6621900) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is N-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide
PubChem CID6621900
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC NameN-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide
SMILESCC(=O)Nc1cc(C)nn1C(C)(C)C
InChIInChI=1S/C10H17N3O/c1-7-6-9(11-8(2)14)13(12-7)10(3,4)5/h6H,1-5H3,(H,11,14)
InChIKeyCTTSVGPBSBJILG-UHFFFAOYSA-N
XLogP1.90
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-amino-3-methyl-1H-pyrazol-1-yl)-6-methyl-3,4-dihydropyrimidin-4-one
CID 135778888
2-(5-amino-3-methyl-1H-pyrazol-1-yl)-6-ethyl-3,4-dihydropyrimidin-4-one
CID 135876292
1-tert-Butyl-3-methyl-1H-pyrazol-5-amine
CID 737200
Butanamide, N-(5-methyl-1H-pyrazol-3-yl)-
CID 5330971
6-ethyl-2,7-dimethyl-1H-pyrazolo[1,5-a]pyrimidin-5-one
CID 135412467
2-Chloro-N-(1,5-dimethyl-1H-pyrazol-3-yl)-acetamide
CID 6485361
2-(5-amino-3-methyl-1H-pyrazol-1-yl)-6-propyl-3,4-dihydropyrimidin-4-one
CID 135876298
2-methyl-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidin-5-one
CID 135600432
N-(1-(4,5-dimethyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl)isobutyramide
CID 135551469
N-(1-(4-ethyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl)acetamide
CID 135753026
N-(3-methyl-1-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-1H-pyrazol-5-yl)isobutyramide
CID 135752890
N-[1-(4-ethyl-6-oxo-1,6-dihydro-2-pyrimidinyl)-3-methyl-5-pyrazolyl]cyclopropanecarboxamide
CID 135753036

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide?
The IUPAC name of N-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide (CID 6621900) is N-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide.
What is the SMILES notation for N-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide?
The canonical SMILES for N-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide is CC(=O)Nc1cc(C)nn1C(C)(C)C.
What is the InChIKey of N-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide?
The InChIKey is CTTSVGPBSBJILG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-7-6-9(11-8(2)14)13(12-7)10(3,4)5/h6H,1-5H3,(H,11,14).
What are the key properties of N-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide?
N-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide has a molecular weight of 195.27 g/mol, XLogP of 1.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butyl-5-methylpyrazol-3-yl)acetamide is sourced from PubChem (CID 6621900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).