4-(pyrrolidin-3-ylmethyl)-1H-pyrazole

C8H13N3 — CID 83479564

IUPAC4-(pyrrolidin-3-ylmethyl)-1H-pyrazole
SMILESc1n[nH]cc1CC1CCNC1
InChIInChI=1S/C8H13N3/c1-2-9-4-7(1)3-8-5-10-11-6-8/h5-7,9H,1-4H2,(H,10,11)
InChIKeyWOOWESLQNWAETI-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.56
Rot. Bonds2

About 4-(pyrrolidin-3-ylmethyl)-1H-pyrazole

4-(pyrrolidin-3-ylmethyl)-1H-pyrazole (PubChem CID 83479564) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 4-(pyrrolidin-3-ylmethyl)-1H-pyrazole.

Molecular Properties

Compound Name4-(pyrrolidin-3-ylmethyl)-1H-pyrazole
PubChem CID83479564
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name4-(pyrrolidin-3-ylmethyl)-1H-pyrazole
SMILESc1n[nH]cc1CC1CCNC1
InChIInChI=1S/C8H13N3/c1-2-9-4-7(1)3-8-5-10-11-6-8/h5-7,9H,1-4H2,(H,10,11)
InChIKeyWOOWESLQNWAETI-UHFFFAOYSA-N
XLogP0.56
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-(pyrrolidin-3-ylmethyl)-1H-pyrazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(1H-pyrazol-4-ylmethyl)azepan-3-ol
CID 83484653
(3R)-3-[(4-fluorophenyl)methyl]pyrrolidine
CID 86309434
2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine
CID 135135099
N-(1H-pyrazol-4-yl)-2-[(3S)-pyrrolidin-3-yl]acetamide
CID 130748030
3-[[4-(fluoromethyl)phenyl]methyl]pyrrolidine
CID 84665010
3-(1H-pyrazol-4-ylmethoxy)piperidine
CID 130569410
3-[(3,4-dichlorophenyl)methyl]pyrrolidine
CID 82158944
N-(1H-pyrazol-4-yl)-2-[(3S)-pyrrolidin-3-yl]acetamide;hydrochloride
CID 130748029
N-(1H-pyrazol-4-ylmethyl)azepan-4-amine
CID 103981696
4-[(3R)-pyrrolidin-3-yl]-1H-pyrazole
CID 96637487
N-(piperidin-4-ylmethyl)-1H-pyrazol-4-amine
CID 79707456
3-(thiophen-3-ylmethyl)pyrrolidine
CID 83682618

Frequently Asked Questions

What is the IUPAC name of 4-(pyrrolidin-3-ylmethyl)-1H-pyrazole?
The IUPAC name of 4-(pyrrolidin-3-ylmethyl)-1H-pyrazole (CID 83479564) is 4-(pyrrolidin-3-ylmethyl)-1H-pyrazole.
What is the SMILES notation for 4-(pyrrolidin-3-ylmethyl)-1H-pyrazole?
The canonical SMILES for 4-(pyrrolidin-3-ylmethyl)-1H-pyrazole is c1n[nH]cc1CC1CCNC1.
What is the InChIKey of 4-(pyrrolidin-3-ylmethyl)-1H-pyrazole?
The InChIKey is WOOWESLQNWAETI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-2-9-4-7(1)3-8-5-10-11-6-8/h5-7,9H,1-4H2,(H,10,11).
What are the key properties of 4-(pyrrolidin-3-ylmethyl)-1H-pyrazole?
4-(pyrrolidin-3-ylmethyl)-1H-pyrazole has a molecular weight of 151.21 g/mol, XLogP of 0.56, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(pyrrolidin-3-ylmethyl)-1H-pyrazole is sourced from PubChem (CID 83479564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).