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

C8H13N3 — CID 118700949

IUPAC5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole
SMILESCCN1Cc2cn(C)nc2C1
InChIInChI=1S/C8H13N3/c1-3-11-5-7-4-10(2)9-8(7)6-11/h4H,3,5-6H2,1-2H3
InChIKeyXECRXYKUOXNBRV-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.76
Rot. Bonds1

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

5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole (PubChem CID 118700949) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole.

Molecular Properties

Compound Name5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole
PubChem CID118700949
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole
SMILESCCN1Cc2cn(C)nc2C1
InChIInChI=1S/C8H13N3/c1-3-11-5-7-4-10(2)9-8(7)6-11/h4H,3,5-6H2,1-2H3
InChIKeyXECRXYKUOXNBRV-UHFFFAOYSA-N
XLogP0.76
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(NE)-N-[(5-methyl-1-propylpyrazol-4-yl)methylidene]hydroxylamine
CID 6886586
(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylamine
CID 578961
1-Ethyl-3-methyl-1H-pyrazole-4-carbaldehyde oxime
CID 6885154
(1-ethyl-5-methyl-1H-pyrazol-4-yl)methanamine
CID 7022221
((1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl)(methyl)amine
CID 7175814
1-methyl-1H,4H,5H,6H-pyrrolo(3,4-c)pyrazole dihydrochloride
CID 54772414
(1,4-dimethyl-1H-pyrazol-3-yl)methanamine dihydrochloride
CID 132351241
(3R)-2-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 110225820
(1,3-dimethyl-1H-pyrazol-4-yl)methanamine
CID 1257622
(1-Ethyl-3-methyl-1H-pyrazol-4-ylmethyl)-methyl-amine
CID 6487607
1,3,4-Trimethylpyrazole
CID 2733984
1,4,5-Trimethylpyrazole
CID 12115801

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole?
The IUPAC name of 5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole (CID 118700949) is 5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole.
What is the SMILES notation for 5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole?
The canonical SMILES for 5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole is CCN1Cc2cn(C)nc2C1.
What is the InChIKey of 5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole?
The InChIKey is XECRXYKUOXNBRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-3-11-5-7-4-10(2)9-8(7)6-11/h4H,3,5-6H2,1-2H3.
What are the key properties of 5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole?
5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole has a molecular weight of 151.21 g/mol, XLogP of 0.76, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole is sourced from PubChem (CID 118700949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).