1-pyrrolidin-2-ylpyrazole

C7H11N3 — CID 18988375

IUPAC1-pyrrolidin-2-ylpyrazole
SMILESc1cnn(C2CCCN2)c1
InChIInChI=1S/C7H11N3/c1-3-7(8-4-1)10-6-2-5-9-10/h2,5-8H,1,3-4H2
InChIKeyPTSDCOGSJXNTBL-UHFFFAOYSA-N
MW137.19 g/mol
LogP0.77
Rot. Bonds1

About 1-pyrrolidin-2-ylpyrazole

1-pyrrolidin-2-ylpyrazole (PubChem CID 18988375) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is 1-pyrrolidin-2-ylpyrazole.

Molecular Properties

Compound Name1-pyrrolidin-2-ylpyrazole
PubChem CID18988375
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name1-pyrrolidin-2-ylpyrazole
SMILESc1cnn(C2CCCN2)c1
InChIInChI=1S/C7H11N3/c1-3-7(8-4-1)10-6-2-5-9-10/h2,5-8H,1,3-4H2
InChIKeyPTSDCOGSJXNTBL-UHFFFAOYSA-N
XLogP0.77
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(pyrrolidin-2-ylmethyl)-1H-pyrazole
CID 25220770
N-(4-Amino-butyl)-pyrazole-1-carboxamidine; hydrochloride
CID 44326665
n-Propyl-1h-pyrazole-1-carboxamide
CID 44306068
N-butylpyrazole-1-carboxamide
CID 44306377
1H-Pyrazole, 1,1'-methylenebis-
CID 123422
3-(1H-pyrazol-1-yl)propan-1-amine
CID 7023140
1-(pyrrolidin-3-yl)-1H-pyrazole
CID 46318284
Bis(2-(1h-pyrazol-1-yl)ethyl)amine
CID 61492073
1,1'-propane-2,2-diylbis(1H-pyrazole)
CID 10921041
Bis(pyrazole-1-yl)ethane
CID 5245495
N-aminomethyl pyrazole
CID 22639496
2,2-Di(pyrazol-1-yl)ethanamine
CID 68529237

Frequently Asked Questions

What is the IUPAC name of 1-pyrrolidin-2-ylpyrazole?
The IUPAC name of 1-pyrrolidin-2-ylpyrazole (CID 18988375) is 1-pyrrolidin-2-ylpyrazole.
What is the SMILES notation for 1-pyrrolidin-2-ylpyrazole?
The canonical SMILES for 1-pyrrolidin-2-ylpyrazole is c1cnn(C2CCCN2)c1.
What is the InChIKey of 1-pyrrolidin-2-ylpyrazole?
The InChIKey is PTSDCOGSJXNTBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3/c1-3-7(8-4-1)10-6-2-5-9-10/h2,5-8H,1,3-4H2.
What are the key properties of 1-pyrrolidin-2-ylpyrazole?
1-pyrrolidin-2-ylpyrazole has a molecular weight of 137.19 g/mol, XLogP of 0.77, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrrolidin-2-ylpyrazole is sourced from PubChem (CID 18988375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).