2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide

C9H16N4O — CID 43185729

IUPAC2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)Cn1cc(N)cn1
InChIInChI=1S/C9H16N4O/c1-7(2)3-11-9(14)6-13-5-8(10)4-12-13/h4-5,7H,3,6,10H2,1-2H3,(H,11,14)
InChIKeyPLOOFBOYYMJGAV-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.24
Rot. Bonds4

About 2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide

2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide (PubChem CID 43185729) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide
PubChem CID43185729
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide
SMILESCC(C)CNC(=O)Cn1cc(N)cn1
InChIInChI=1S/C9H16N4O/c1-7(2)3-11-9(14)6-13-5-8(10)4-12-13/h4-5,7H,3,6,10H2,1-2H3,(H,11,14)
InChIKeyPLOOFBOYYMJGAV-UHFFFAOYSA-N
XLogP0.24
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-aminopyrazol-1-yl)-N-(2-piperidin-1-ylpropyl)acetamide
CID 61139051
2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxypropan-2-yl]acetamide
CID 93081118
2-(4-aminopyrazol-1-yl)-N-(2-hydroxyethyl)acetamide
CID 43445471
2-(4-aminopyrazol-1-yl)-N-methyl-N-(2-methylpropyl)acetamide
CID 43445500
2-(4-aminopyrazol-1-yl)-N-heptan-2-ylacetamide
CID 43575022
2-(4-aminopyrazol-1-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 43445342
2-(4-aminopyrazol-1-yl)-N-(4-methyloxan-4-yl)acetamide
CID 113490968
N-[2-(4-aminopyrazol-1-yl)ethyl]-4-methylpentanamide
CID 115319745
2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxybutan-2-yl]acetamide
CID 107211178
3-[[2-(4-aminopyrazol-1-yl)acetyl]amino]-N,N-dimethylpropanamide
CID 61102926
2-(4-aminopyrazol-1-yl)-N-(2-methoxy-2-methylpropyl)acetamide
CID 104758227
2-(4-aminopyrazol-1-yl)-N-benzylacetamide
CID 28973852

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide (CID 43185729) is 2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide is CC(C)CNC(=O)Cn1cc(N)cn1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide?
The InChIKey is PLOOFBOYYMJGAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-7(2)3-11-9(14)6-13-5-8(10)4-12-13/h4-5,7H,3,6,10H2,1-2H3,(H,11,14).
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide?
2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide has a molecular weight of 196.25 g/mol, XLogP of 0.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 43185729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).