5-cyclobutyl-1-(3-methylbutyl)pyrazole

C12H20N2 — CID 174757687

IUPAC5-cyclobutyl-1-(3-methylbutyl)pyrazole
SMILESCC(C)CCn1nccc1C1CCC1
InChIInChI=1S/C12H20N2/c1-10(2)7-9-14-12(6-8-13-14)11-4-3-5-11/h6,8,10-11H,3-5,7,9H2,1-2H3
InChIKeyMENMANYDAXQSEZ-UHFFFAOYSA-N
MW192.31 g/mol
LogP3.20
Rot. Bonds4

About 5-cyclobutyl-1-(3-methylbutyl)pyrazole

5-cyclobutyl-1-(3-methylbutyl)pyrazole (PubChem CID 174757687) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 5-cyclobutyl-1-(3-methylbutyl)pyrazole.

Molecular Properties

Compound Name5-cyclobutyl-1-(3-methylbutyl)pyrazole
PubChem CID174757687
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name5-cyclobutyl-1-(3-methylbutyl)pyrazole
SMILESCC(C)CCn1nccc1C1CCC1
InChIInChI=1S/C12H20N2/c1-10(2)7-9-14-12(6-8-13-14)11-4-3-5-11/h6,8,10-11H,3-5,7,9H2,1-2H3
InChIKeyMENMANYDAXQSEZ-UHFFFAOYSA-N
XLogP3.20
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-cyclobutyl-1-(3-methylbutyl)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

4H,5H,6H,7H-pyrazolo(1,5-a)pyridine
CID 13785278
Dipropyl-(4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridin-5-yl)-amine
CID 11356479
Dipropyl-(S)-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridin-5-yl-amine
CID 11615489
3-Ethyl-1-methyl-1H-pyrazole
CID 12581083
1-methyl-3-(propan-2-yl)-1H-pyrazole
CID 12251378
4-((1-methyl-1H-pyrazol-5-yl)methyl)piperidine
CID 63961604
Dipropyl-(R)-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyridin-5-yl-amine
CID 11708363
1-Methyl-3-t-butylpyrazole
CID 145633
rac-(1R,2R)-2-(1-methyl-1H-pyrazol-5-yl)cyclopropan-1-amine dihydrochloride
CID 129841629
3-cyclopropyl-1-methyl-1H-pyrazole
CID 23300060
3-cyclopropyl-1-ethyl-1H-pyrazole
CID 25247549
5-cyclopropyl-1-methyl-1H-pyrazole
CID 25247754

Frequently Asked Questions

What is the IUPAC name of 5-cyclobutyl-1-(3-methylbutyl)pyrazole?
The IUPAC name of 5-cyclobutyl-1-(3-methylbutyl)pyrazole (CID 174757687) is 5-cyclobutyl-1-(3-methylbutyl)pyrazole.
What is the SMILES notation for 5-cyclobutyl-1-(3-methylbutyl)pyrazole?
The canonical SMILES for 5-cyclobutyl-1-(3-methylbutyl)pyrazole is CC(C)CCn1nccc1C1CCC1.
What is the InChIKey of 5-cyclobutyl-1-(3-methylbutyl)pyrazole?
The InChIKey is MENMANYDAXQSEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-10(2)7-9-14-12(6-8-13-14)11-4-3-5-11/h6,8,10-11H,3-5,7,9H2,1-2H3.
What are the key properties of 5-cyclobutyl-1-(3-methylbutyl)pyrazole?
5-cyclobutyl-1-(3-methylbutyl)pyrazole has a molecular weight of 192.31 g/mol, XLogP of 3.20, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclobutyl-1-(3-methylbutyl)pyrazole is sourced from PubChem (CID 174757687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).