2,5-diethyl-3-methyl-1,5-dihydropyrazole

C8H16N2 — CID 156877119

IUPAC2,5-diethyl-3-methyl-1,5-dihydropyrazole
SMILESCCC1C=C(C)N(CC)N1
InChIInChI=1S/C8H16N2/c1-4-8-6-7(3)10(5-2)9-8/h6,8-9H,4-5H2,1-3H3
InChIKeyLINYETUSRBYGGN-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.51
Rot. Bonds2

About 2,5-diethyl-3-methyl-1,5-dihydropyrazole

2,5-diethyl-3-methyl-1,5-dihydropyrazole (PubChem CID 156877119) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 2,5-diethyl-3-methyl-1,5-dihydropyrazole.

Molecular Properties

Compound Name2,5-diethyl-3-methyl-1,5-dihydropyrazole
PubChem CID156877119
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name2,5-diethyl-3-methyl-1,5-dihydropyrazole
SMILESCCC1C=C(C)N(CC)N1
InChIInChI=1S/C8H16N2/c1-4-8-6-7(3)10(5-2)9-8/h6,8-9H,4-5H2,1-3H3
InChIKeyLINYETUSRBYGGN-UHFFFAOYSA-N
XLogP1.51
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Pyrazole, dihydro-3,5-dimethyl-
CID 4867585
N-(2,7-octadienyl)-5-methylpyrazoline
CID 129811128
N-(2,7-octadi-enyl)-3,5,5-trimethylpyrazoline
CID 129811189
2,3,5-Trimethyl-1,5-dihydropyrazole
CID 59073866
(3S)-5-tert-butyl-2,3-dimethyl-1,3-dihydropyrazole
CID 59864780
2,5-Dipentyl-1,3-dihydropyrazole
CID 66654838
5-Tert-butyl-2,3-dimethyl-1,3-dihydropyrazole
CID 72581774
2,3,5-Trimethyl-1,3-dihydropyrazole
CID 90911966
2-(2,3-dihydro-1H-pyrazol-5-yl)-N-ethyl-N-methylethanamine
CID 118617278
6-(1,3,5-trimethyl-2H-triazol-4-yl)hexa-3,4-dien-2-amine
CID 123369821
3-Methyl-2-(4-methylcyclohexa-2,4-dien-1-yl)-1,5-dihydropyrazole
CID 123632362
1-Ethyl-2-methyl-1-pent-2-en-3-ylhydrazine
CID 123714087

Frequently Asked Questions

What is the IUPAC name of 2,5-diethyl-3-methyl-1,5-dihydropyrazole?
The IUPAC name of 2,5-diethyl-3-methyl-1,5-dihydropyrazole (CID 156877119) is 2,5-diethyl-3-methyl-1,5-dihydropyrazole.
What is the SMILES notation for 2,5-diethyl-3-methyl-1,5-dihydropyrazole?
The canonical SMILES for 2,5-diethyl-3-methyl-1,5-dihydropyrazole is CCC1C=C(C)N(CC)N1.
What is the InChIKey of 2,5-diethyl-3-methyl-1,5-dihydropyrazole?
The InChIKey is LINYETUSRBYGGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-4-8-6-7(3)10(5-2)9-8/h6,8-9H,4-5H2,1-3H3.
What are the key properties of 2,5-diethyl-3-methyl-1,5-dihydropyrazole?
2,5-diethyl-3-methyl-1,5-dihydropyrazole has a molecular weight of 140.23 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diethyl-3-methyl-1,5-dihydropyrazole is sourced from PubChem (CID 156877119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).