N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide

C14H17N3O — CID 60549343

IUPACN-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide
SMILESCC(C)N(C(=O)Cn1cccn1)c1ccccc1
InChIInChI=1S/C14H17N3O/c1-12(2)17(13-7-4-3-5-8-13)14(18)11-16-10-6-9-15-16/h3-10,12H,11H2,1-2H3
InChIKeyNMFBVAGACWXWFK-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.32
Rot. Bonds4

About N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide

N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide (PubChem CID 60549343) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide.

Molecular Properties

Compound NameN-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide
PubChem CID60549343
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide
SMILESCC(C)N(C(=O)Cn1cccn1)c1ccccc1
InChIInChI=1S/C14H17N3O/c1-12(2)17(13-7-4-3-5-8-13)14(18)11-16-10-6-9-15-16/h3-10,12H,11H2,1-2H3
InChIKeyNMFBVAGACWXWFK-UHFFFAOYSA-N
XLogP2.32
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-methylimidazol-2-yl)sulfanyl-N-phenyl-N-propan-2-ylacetamide
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CID 62059766
N-propan-2-yl-2-pyrazol-1-yl-N-(pyridin-2-ylmethyl)acetamide
CID 51088398
N-phenyl-N-propan-2-yl-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)acetamide
CID 7558393
2-(3-hydroxyazetidin-1-yl)-N-phenyl-N-propan-2-ylacetamide
CID 63282516
2-(6-oxo-2-pyrazol-1-yl-1H-pyrimidin-5-yl)-N-phenyl-N-propan-2-ylacetamide
CID 158179627
N-(cyanomethyl)-N-propan-2-yl-2-pyrazol-1-ylacetamide
CID 103758646
N-phenyl-N-propan-2-yl-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]acetamide
CID 55462200
3-methyl-1-pyrazol-1-ylbutan-2-one
CID 59531413
N-phenyl-N-propan-2-yl-2-([1,2,4]triazolo[4,3-a]pyridin-3-yloxy)acetamide
CID 9355703
2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-phenyl-N-propan-2-ylacetamide
CID 55309277
2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-phenyl-N-propan-2-ylacetamide
CID 9437310

Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide?
The IUPAC name of N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide (CID 60549343) is N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide.
What is the SMILES notation for N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide?
The canonical SMILES for N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide is CC(C)N(C(=O)Cn1cccn1)c1ccccc1.
What is the InChIKey of N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide?
The InChIKey is NMFBVAGACWXWFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-12(2)17(13-7-4-3-5-8-13)14(18)11-16-10-6-9-15-16/h3-10,12H,11H2,1-2H3.
What are the key properties of N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide?
N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide has a molecular weight of 243.31 g/mol, XLogP of 2.32, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-propan-2-yl-2-pyrazol-1-ylacetamide is sourced from PubChem (CID 60549343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).