1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole

C11H15N3 — CID 164661981

IUPAC1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole
SMILESCC(C)(Cn1cccc1)n1cccn1
InChIInChI=1S/C11H15N3/c1-11(2,14-9-5-6-12-14)10-13-7-3-4-8-13/h3-9H,10H2,1-2H3
InChIKeyTXVBAODIHKWJLU-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.12
Rot. Bonds3

About 1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole

1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole (PubChem CID 164661981) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole.

Molecular Properties

Compound Name1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole
PubChem CID164661981
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole
SMILESCC(C)(Cn1cccc1)n1cccn1
InChIInChI=1S/C11H15N3/c1-11(2,14-9-5-6-12-14)10-13-7-3-4-8-13/h3-9H,10H2,1-2H3
InChIKeyTXVBAODIHKWJLU-UHFFFAOYSA-N
XLogP2.12
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)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-(2,4,4-trimethylpentan-2-yl)pyrazole
CID 123161936
1-tert-butylpyrazole;ethane;methane
CID 159210260
1-tert-butylpyrazole;2,2-dimethylpropane;ethane;methane
CID 161305054
1-(1,1,2,2-tetrafluoropropyl)pyrazole
CID 137473825
1-(2,2-dimethylbutyl)pyrrole
CID 103463815
1-[2-methoxy-1,1-di(pyrazol-1-yl)ethyl]pyrazole
CID 24999461
1-(1,1-diphenylethyl)pyrazole
CID 58756168
2-cyclopropyl-2-pyrazol-1-ylpropan-1-amine
CID 82502923
diethyl 2-methyl-2-pyrazol-1-ylpropanedioate
CID 126673792
2,2-dimethyl-3-pyrrol-1-ylpropanoyl chloride
CID 174894503
1-(1,1,2,2,2-pentafluoroethyl)pyrazole
CID 87584131
CID 166123273
CID 166123273

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole?
The IUPAC name of 1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole (CID 164661981) is 1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole.
What is the SMILES notation for 1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole?
The canonical SMILES for 1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole is CC(C)(Cn1cccc1)n1cccn1.
What is the InChIKey of 1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole?
The InChIKey is TXVBAODIHKWJLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-11(2,14-9-5-6-12-14)10-13-7-3-4-8-13/h3-9H,10H2,1-2H3.
What are the key properties of 1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole?
1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole has a molecular weight of 189.26 g/mol, XLogP of 2.12, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-1-pyrrol-1-ylpropan-2-yl)pyrazole is sourced from PubChem (CID 164661981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).