6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole

C9H14N2 — CID 163390349

IUPAC6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole
SMILESCCC1CCc2c1n[nH]c2C
InChIInChI=1S/C9H14N2/c1-3-7-4-5-8-6(2)10-11-9(7)8/h7H,3-5H2,1-2H3,(H,10,11)
InChIKeyAQOGPYGADJGXDY-UHFFFAOYSA-N
MW150.22 g/mol
LogP2.16
Rot. Bonds1

About 6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole

6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole (PubChem CID 163390349) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole.

Molecular Properties

Compound Name6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole
PubChem CID163390349
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole
SMILESCCC1CCc2c1n[nH]c2C
InChIInChI=1S/C9H14N2/c1-3-7-4-5-8-6(2)10-11-9(7)8/h7H,3-5H2,1-2H3,(H,10,11)
InChIKeyAQOGPYGADJGXDY-UHFFFAOYSA-N
XLogP2.16
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-Pentyl-4,5,6,7-tetrahydro-1H-indazole
CID 585962
3,5-Diethyl-4-methylpyrazole
CID 139517
3-methyl-4,5,6,7-tetrahydro-1H-indazole
CID 312127
3,5-Di-t-butyl-4-methylpyrazole
CID 140411
3,4,4-trimethyl-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazole
CID 2855977
3-Methyl-1,4,5,6,7,8-hexahydrocyclohepta[c]pyrazole
CID 23279515
1H,4H,5H,6H-cyclopenta[c]pyrazole-3-carbonitrile
CID 23135139
(3BS,4AR)-3,4,4-Trimethyl-3B,4,4A,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-C]pyrazole
CID 766473
3-ethyl-4,5-dimethyl-1H-pyrazole
CID 2753139
4-Ethyl-3,5-dipropyl-1H-pyrazole
CID 586388
3-Methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole
CID 12204862
3-Isopropyl-4,5,6,7-tetrahydro-1H-indazole
CID 5226481

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole?
The IUPAC name of 6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole (CID 163390349) is 6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole.
What is the SMILES notation for 6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole?
The canonical SMILES for 6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole is CCC1CCc2c1n[nH]c2C.
What is the InChIKey of 6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole?
The InChIKey is AQOGPYGADJGXDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-3-7-4-5-8-6(2)10-11-9(7)8/h7H,3-5H2,1-2H3,(H,10,11).
What are the key properties of 6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole?
6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole has a molecular weight of 150.22 g/mol, XLogP of 2.16, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazole is sourced from PubChem (CID 163390349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).