1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole

C11H16N6 — CID 174856274

IUPAC1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole
SMILESc1cnn(CN2CCN(Cn3cccn3)C2)c1
InChIInChI=1S/C11H16N6/c1-3-12-16(5-1)10-14-7-8-15(9-14)11-17-6-2-4-13-17/h1-6H,7-11H2
InChIKeyRGUYRTPPJSCZEI-UHFFFAOYSA-N
MW232.29 g/mol
LogP0.27
Rot. Bonds4

About 1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole

1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole (PubChem CID 174856274) has the molecular formula C11H16N6 and a molecular weight of 232.29 g/mol. Its IUPAC name is 1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole.

Molecular Properties

Compound Name1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole
PubChem CID174856274
Molecular FormulaC11H16N6
Molecular Weight232.29 g/mol
Exact Mass232.14
IUPAC Name1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole
SMILESc1cnn(CN2CCN(Cn3cccn3)C2)c1
InChIInChI=1S/C11H16N6/c1-3-12-16(5-1)10-14-7-8-15(9-14)11-17-6-2-4-13-17/h1-6H,7-11H2
InChIKeyRGUYRTPPJSCZEI-UHFFFAOYSA-N
XLogP0.27
TPSA42.12 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-[dideuterio(pyrazol-1-yl)methyl]pyrazole
CID 131845717
1-ethylpyrazole;propane
CID 142296683
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CID 19751693
1-[(pyrazol-1-ylmethyldisulfanyl)methyl]pyrazole
CID 87477588
1-[[2,3,4,5,6-pentakis(pyrazol-1-ylmethyl)phenyl]methyl]pyrazole
CID 15190545
2-pyrazol-1-yl-1-[4-(2-pyrazol-1-ylethyl)piperazin-1-yl]ethanone
CID 90508652
(3R,4S)-1-(2-pyrazol-1-ylethyl)pyrrolidine-3,4-diol
CID 115278412
5-methyl-3-(pyrazol-1-ylmethyl)-1,3,4-thiadiazol-2-one
CID 130610602
4-chloro-1-(pyrazol-1-ylmethyl)pyrazole-3-carboxylic acid
CID 19618549
N'-hydroxy-2-[4-(2-pyrazol-1-ylethyl)piperazin-1-yl]ethanimidamide
CID 55201572
1-(2-pyrazol-1-ylethyl)piperazin-2-one
CID 62310612
N-methyl-2-piperazin-1-yl-N-(2-pyrazol-1-ylethyl)ethanamine
CID 63266461

Frequently Asked Questions

What is the IUPAC name of 1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole?
The IUPAC name of 1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole (CID 174856274) is 1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole.
What is the SMILES notation for 1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole?
The canonical SMILES for 1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole is c1cnn(CN2CCN(Cn3cccn3)C2)c1.
What is the InChIKey of 1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole?
The InChIKey is RGUYRTPPJSCZEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6/c1-3-12-16(5-1)10-14-7-8-15(9-14)11-17-6-2-4-13-17/h1-6H,7-11H2.
What are the key properties of 1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole?
1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole has a molecular weight of 232.29 g/mol, XLogP of 0.27, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[3-(pyrazol-1-ylmethyl)imidazolidin-1-yl]methyl]pyrazole is sourced from PubChem (CID 174856274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).