2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide

C7H12N4O — CID 20784744

IUPAC2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide
SMILESCN(C)CC(=O)Nc1cn[nH]c1
InChIInChI=1S/C7H12N4O/c1-11(2)5-7(12)10-6-3-8-9-4-6/h3-4H,5H2,1-2H3,(H,8,9)(H,10,12)
InChIKeyXZKPQOAEFUNXON-UHFFFAOYSA-N
MW168.20 g/mol
LogP-0.09
Rot. Bonds3

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

2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide (PubChem CID 20784744) has the molecular formula C7H12N4O and a molecular weight of 168.20 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide
PubChem CID20784744
Molecular FormulaC7H12N4O
Molecular Weight168.20 g/mol
Exact Mass168.10
IUPAC Name2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide
SMILESCN(C)CC(=O)Nc1cn[nH]c1
InChIInChI=1S/C7H12N4O/c1-11(2)5-7(12)10-6-3-8-9-4-6/h3-4H,5H2,1-2H3,(H,8,9)(H,10,12)
InChIKeyXZKPQOAEFUNXON-UHFFFAOYSA-N
XLogP-0.09
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide?
The IUPAC name of 2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide (CID 20784744) is 2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide?
The canonical SMILES for 2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide is CN(C)CC(=O)Nc1cn[nH]c1.
What is the InChIKey of 2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide?
The InChIKey is XZKPQOAEFUNXON-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4O/c1-11(2)5-7(12)10-6-3-8-9-4-6/h3-4H,5H2,1-2H3,(H,8,9)(H,10,12).
What are the key properties of 2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide?
2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide has a molecular weight of 168.20 g/mol, XLogP of -0.09, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(1H-pyrazol-4-yl)acetamide is sourced from PubChem (CID 20784744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).