3,4-dimethyl-1-propan-2-ylpyrazole;ethane

C10H20N2 — CID 144607335

IUPAC3,4-dimethyl-1-propan-2-ylpyrazole;ethane
SMILESCC.Cc1cn(C(C)C)nc1C
InChIInChI=1S/C8H14N2.C2H6/c1-6(2)10-5-7(3)8(4)9-10;1-2/h5-6H,1-4H3;1-2H3
InChIKeyUJSSHZKKQQDJQW-UHFFFAOYSA-N
MW168.28 g/mol
LogP3.11
Rot. Bonds1

About 3,4-dimethyl-1-propan-2-ylpyrazole;ethane

3,4-dimethyl-1-propan-2-ylpyrazole;ethane (PubChem CID 144607335) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 3,4-dimethyl-1-propan-2-ylpyrazole;ethane.

Molecular Properties

Compound Name3,4-dimethyl-1-propan-2-ylpyrazole;ethane
PubChem CID144607335
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name3,4-dimethyl-1-propan-2-ylpyrazole;ethane
SMILESCC.Cc1cn(C(C)C)nc1C
InChIInChI=1S/C8H14N2.C2H6/c1-6(2)10-5-7(3)8(4)9-10;1-2/h5-6H,1-4H3;1-2H3
InChIKeyUJSSHZKKQQDJQW-UHFFFAOYSA-N
XLogP3.11
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3,4-dimethyl-1-propan-2-ylpyrazole;ethane 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-(1-fluoroethyl)-3,4-dimethylpyrazole
CID 144872829
3-bromo-4-methyl-1-propan-2-ylpyrazole
CID 130138856
3,4-dimethyl-1-(1-phenylethyl)pyrazole;ethane
CID 145058285
ethane;4-methyl-1-propan-2-ylpyrazole-3-carboxamide
CID 144607430
4-methyl-3-phenyl-1-propan-2-ylpyrazole
CID 123403415
3-(2,6-dichlorophenyl)-4-methyl-1-propan-2-ylpyrazole;ethane
CID 142566077
4-methyl-3-(2-methylphenyl)-1-propan-2-ylpyrazole
CID 142566344
3-methyl-1-propan-2-yl-N-propylpyrazol-4-amine
CID 122169047
3-methyl-2-(4-methyl-1-propan-2-ylpyrazol-3-yl)pyridine
CID 142565987
(4-bromo-1-methylpyrazol-3-yl)-(4-methyl-1-propan-2-ylpyrazol-3-yl)diazene
CID 162540292
3-methyl-1-propan-2-yl-N-propylpyrazol-4-amine;hydrochloride
CID 126964438
4-methyl-6-(3-methyl-1-propan-2-ylpyrazol-4-yl)pyridin-3-amine
CID 114256490

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-1-propan-2-ylpyrazole;ethane?
The IUPAC name of 3,4-dimethyl-1-propan-2-ylpyrazole;ethane (CID 144607335) is 3,4-dimethyl-1-propan-2-ylpyrazole;ethane.
What is the SMILES notation for 3,4-dimethyl-1-propan-2-ylpyrazole;ethane?
The canonical SMILES for 3,4-dimethyl-1-propan-2-ylpyrazole;ethane is CC.Cc1cn(C(C)C)nc1C.
What is the InChIKey of 3,4-dimethyl-1-propan-2-ylpyrazole;ethane?
The InChIKey is UJSSHZKKQQDJQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2.C2H6/c1-6(2)10-5-7(3)8(4)9-10;1-2/h5-6H,1-4H3;1-2H3.
What are the key properties of 3,4-dimethyl-1-propan-2-ylpyrazole;ethane?
3,4-dimethyl-1-propan-2-ylpyrazole;ethane has a molecular weight of 168.28 g/mol, XLogP of 3.11, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-1-propan-2-ylpyrazole;ethane is sourced from PubChem (CID 144607335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).