butane;1,5-dimethylpyrazole;ethane

C15H34N2 — CID 142280941

IUPACbutane;1,5-dimethylpyrazole;ethane
SMILESCC.CCCC.CCCC.Cc1ccnn1C
InChIInChI=1S/C5H8N2.2C4H10.C2H6/c1-5-3-4-6-7(5)2;2*1-3-4-2;1-2/h3-4H,1-2H3;2*3-4H2,1-2H3;1-2H3
InChIKeyFJFNRXTYCDTREO-UHFFFAOYSA-N
MW242.45 g/mol
LogP5.37
Rot. Bonds2

About butane;1,5-dimethylpyrazole;ethane

butane;1,5-dimethylpyrazole;ethane (PubChem CID 142280941) has the molecular formula C15H34N2 and a molecular weight of 242.45 g/mol. Its IUPAC name is butane;1,5-dimethylpyrazole;ethane.

Molecular Properties

Compound Namebutane;1,5-dimethylpyrazole;ethane
PubChem CID142280941
Molecular FormulaC15H34N2
Molecular Weight242.45 g/mol
Exact Mass242.27
IUPAC Namebutane;1,5-dimethylpyrazole;ethane
SMILESCC.CCCC.CCCC.Cc1ccnn1C
InChIInChI=1S/C5H8N2.2C4H10.C2H6/c1-5-3-4-6-7(5)2;2*1-3-4-2;1-2/h3-4H,1-2H3;2*3-4H2,1-2H3;1-2H3
InChIKeyFJFNRXTYCDTREO-UHFFFAOYSA-N
XLogP5.37
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500242.45
LogP ≤ 55.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze butane;1,5-dimethylpyrazole;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

1,5-dimethylpyrazole;2,4-dimethylpyridine;methane
CID 167606075
ethane;5-ethoxy-1-methylpyrazole;propane
CID 154649349
1,3-dimethylpyrazole;1,5-dimethylpyrazole;1,2-dimethylpyrrole;ethane
CID 158873973
5-(bromomethyl)-1-methylpyrazole
CID 59589503
2,4-dimethylpyridazin-3-one;ethane
CID 145471849
ethane;(2-methylpyrazol-3-yl)methanol
CID 144625468
ethyl 2,3-dihydroxy-3-(2-methylpyrazol-3-yl)propanoate
CID 171867144
ethane;N-methyl-2-(5-methylpyrazol-1-yl)ethanamine
CID 156847760
5-methyl-1-(2-propylsulfonylethyl)pyrazole
CID 106731583
N-(2-methylpyrazol-3-yl)-4-(propylamino)benzenesulfonamide
CID 62157548
4-ethyl-N-(2-methylpyrazol-3-yl)benzenesulfonamide
CID 25048296
N,N,2-trimethylpyrazol-3-amine
CID 70700698

Frequently Asked Questions

What is the IUPAC name of butane;1,5-dimethylpyrazole;ethane?
The IUPAC name of butane;1,5-dimethylpyrazole;ethane (CID 142280941) is butane;1,5-dimethylpyrazole;ethane.
What is the SMILES notation for butane;1,5-dimethylpyrazole;ethane?
The canonical SMILES for butane;1,5-dimethylpyrazole;ethane is CC.CCCC.CCCC.Cc1ccnn1C.
What is the InChIKey of butane;1,5-dimethylpyrazole;ethane?
The InChIKey is FJFNRXTYCDTREO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2.2C4H10.C2H6/c1-5-3-4-6-7(5)2;2*1-3-4-2;1-2/h3-4H,1-2H3;2*3-4H2,1-2H3;1-2H3.
What are the key properties of butane;1,5-dimethylpyrazole;ethane?
butane;1,5-dimethylpyrazole;ethane has a molecular weight of 242.45 g/mol, XLogP of 5.37, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butane;1,5-dimethylpyrazole;ethane is sourced from PubChem (CID 142280941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).