N,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide

C7H11N3O — CID 91481797

IUPACN,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide
SMILESCN(C)C(=O)Cc1cn[nH]c1
InChIInChI=1S/C7H11N3O/c1-10(2)7(11)3-6-4-8-9-5-6/h4-5H,3H2,1-2H3,(H,8,9)
InChIKeyGTVJAOSPKUDPPA-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.04
Rot. Bonds2

About N,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide

N,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide (PubChem CID 91481797) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is N,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide
PubChem CID91481797
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC NameN,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide
SMILESCN(C)C(=O)Cc1cn[nH]c1
InChIInChI=1S/C7H11N3O/c1-10(2)7(11)3-6-4-8-9-5-6/h4-5H,3H2,1-2H3,(H,8,9)
InChIKeyGTVJAOSPKUDPPA-UHFFFAOYSA-N
XLogP0.04
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide?
The IUPAC name of N,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide (CID 91481797) is N,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide?
The canonical SMILES for N,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide is CN(C)C(=O)Cc1cn[nH]c1.
What is the InChIKey of N,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide?
The InChIKey is GTVJAOSPKUDPPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-10(2)7(11)3-6-4-8-9-5-6/h4-5H,3H2,1-2H3,(H,8,9).
What are the key properties of N,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide?
N,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide has a molecular weight of 153.19 g/mol, XLogP of 0.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(1H-pyrazol-4-yl)acetamide is sourced from PubChem (CID 91481797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).