N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride

C11H19ClN4O — CID 119797911

IUPACN-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
SMILESCc1c(NC(=O)CC2CCCN2)cnn1C.Cl
InChIInChI=1S/C11H18N4O.ClH/c1-8-10(7-13-15(8)2)14-11(16)6-9-4-3-5-12-9;/h7,9,12H,3-6H2,1-2H3,(H,14,16);1H
InChIKeyWFIFGOWVLSKLJG-UHFFFAOYSA-N
MW258.75 g/mol
LogP1.23
Rot. Bonds3

About N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride

N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride (PubChem CID 119797911) has the molecular formula C11H19ClN4O and a molecular weight of 258.75 g/mol. Its IUPAC name is N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
PubChem CID119797911
Molecular FormulaC11H19ClN4O
Molecular Weight258.75 g/mol
Exact Mass258.12
IUPAC NameN-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
SMILESCc1c(NC(=O)CC2CCCN2)cnn1C.Cl
InChIInChI=1S/C11H18N4O.ClH/c1-8-10(7-13-15(8)2)14-11(16)6-9-4-3-5-12-9;/h7,9,12H,3-6H2,1-2H3,(H,14,16);1H
InChIKeyWFIFGOWVLSKLJG-UHFFFAOYSA-N
XLogP1.23
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.75
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride?
The IUPAC name of N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride (CID 119797911) is N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride.
What is the SMILES notation for N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride?
The canonical SMILES for N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride is Cc1c(NC(=O)CC2CCCN2)cnn1C.Cl.
What is the InChIKey of N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride?
The InChIKey is WFIFGOWVLSKLJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O.ClH/c1-8-10(7-13-15(8)2)14-11(16)6-9-4-3-5-12-9;/h7,9,12H,3-6H2,1-2H3,(H,14,16);1H.
What are the key properties of N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride?
N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride has a molecular weight of 258.75 g/mol, XLogP of 1.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-dimethylpyrazol-4-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride is sourced from PubChem (CID 119797911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).