5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole

C9H15N3 — CID 22853218

IUPAC5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole
SMILESCc1cc([C@@H]2CCCN2C)n[nH]1
InChIInChI=1S/C9H15N3/c1-7-6-8(11-10-7)9-4-3-5-12(9)2/h6,9H,3-5H2,1-2H3,(H,10,11)/t9-/m0/s1
InChIKeyZIGAUPPMUALBEJ-VIFPVBQESA-N
MW165.24 g/mol
LogP1.48
Rot. Bonds1

About 5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole

5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole (PubChem CID 22853218) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole.

Molecular Properties

Compound Name5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole
PubChem CID22853218
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole
SMILESCc1cc([C@@H]2CCCN2C)n[nH]1
InChIInChI=1S/C9H15N3/c1-7-6-8(11-10-7)9-4-3-5-12(9)2/h6,9H,3-5H2,1-2H3,(H,10,11)/t9-/m0/s1
InChIKeyZIGAUPPMUALBEJ-VIFPVBQESA-N
XLogP1.48
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-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

1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine
CID 786815
(3-ethyl-1H-pyrazol-5-yl)methanamine
CID 23006039
((5-tert-butyl-1H-pyrazol-3-yl)methyl)(methyl)amine
CID 44236865
1-(5-Cyclopropyl-1H-pyrazol-3-YL)-N-methylmethanamine
CID 44236867
N-methyl-1-(5-methyl-1H-pyrazol-3-yl)methanamine
CID 3157457
3-(pyrrolidin-2-yl)-1H-pyrazole
CID 23282562
1-(5-methyl-1H-pyrazol-3-yl)propan-2-amine
CID 5102523
1,4-dithiepan-6-yl(methyl)[(5-propyl-1H-pyrazol-3-yl)methyl]amine
CID 50955270
N-methyl-N-[(5-propyl-1H-pyrazol-3-yl)methyl]tetrahydro-2H-thiopyran-4-amine
CID 50974668
N,2,2,6,6-Pentamethyl-N-[(5-propyl-1H-pyrazol-3-YL)methyl]piperidin-4-amine
CID 56748665
6,19-Dioctyl-3,6,9,12,13,16,19,22,25,26-decazatricyclo[22.2.1.111,14]octacosa-1(26),11,14(28),24(27)-tetraene;hydrochloride
CID 70697170
3-(1-Isopropylpyrrolidin-2-YL)-5-(trifluoromethyl)-1H-pyrazole
CID 110249230

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole?
The IUPAC name of 5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole (CID 22853218) is 5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole.
What is the SMILES notation for 5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole?
The canonical SMILES for 5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole is Cc1cc([C@@H]2CCCN2C)n[nH]1.
What is the InChIKey of 5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole?
The InChIKey is ZIGAUPPMUALBEJ-VIFPVBQESA-N. The full InChI is InChI=1S/C9H15N3/c1-7-6-8(11-10-7)9-4-3-5-12(9)2/h6,9H,3-5H2,1-2H3,(H,10,11)/t9-/m0/s1.
What are the key properties of 5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole?
5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole has a molecular weight of 165.24 g/mol, XLogP of 1.48, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]-1H-pyrazole is sourced from PubChem (CID 22853218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).