3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole

C10H13N5 — CID 118614122

IUPAC3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole
SMILESCCn1c(-c2ccn[nH]2)nc2c1CNC2
InChIInChI=1S/C10H13N5/c1-2-15-9-6-11-5-8(9)13-10(15)7-3-4-12-14-7/h3-4,11H,2,5-6H2,1H3,(H,12,14)
InChIKeyOGJLSUXNLLDJTA-UHFFFAOYSA-N
MW203.25 g/mol
LogP0.90
Rot. Bonds2

About 3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole

3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole (PubChem CID 118614122) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is 3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole.

Molecular Properties

Compound Name3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole
PubChem CID118614122
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC Name3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole
SMILESCCn1c(-c2ccn[nH]2)nc2c1CNC2
InChIInChI=1S/C10H13N5/c1-2-15-9-6-11-5-8(9)13-10(15)7-3-4-12-14-7/h3-4,11H,2,5-6H2,1H3,(H,12,14)
InChIKeyOGJLSUXNLLDJTA-UHFFFAOYSA-N
XLogP0.90
TPSA58.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-Methyl-1H-imidazo[1,2-b]pyrazole
CID 543171
3-(1-methyl-1H-imidazol-2-yl)-1H-pyrazol-5-amine
CID 71685845
3-(1H-pyrazol-5-yl)-6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazole
CID 2315252
1-ethyl-3-{5H,6H,7H-pyrrolo[2,1-c][1,2,4]triazol-3-yl}pyrazol-4-amine
CID 25248658
Dimethyl({2-[1-(1H-pyrazol-3-ylmethyl)pyrrolidin-2-YL]pyrimidin-4-YL}methyl)amine
CID 110117145
2-(1H-pyrazol-5-yl)-1H-imidazole-5-carbonitrile
CID 136144099
1-methyl-3-(1-methyl-1H-imidazol-2-yl)-1H-pyrazol-5-amine
CID 13861132
Imidazolylpyrazole
CID 136029224
3-(Difluoromethyl)-5-hydroxy-2-(1-methylpyrazol-3-yl)-4,6-dihydropyrrolo[3,4-d]imidazole
CID 118614102
2-[1-(Difluoromethyl)pyrazol-3-yl]-5-hydroxy-3-methyl-4,6-dihydropyrrolo[3,4-d]imidazole
CID 118614151
2-[2-(Difluoromethyl)pyrazol-3-yl]-5-hydroxy-3-methyl-4,6-dihydropyrrolo[3,4-d]imidazole
CID 118614186
2-[1-(Difluoromethyl)pyrazol-3-yl]-3-ethyl-5-hydroxy-4,6-dihydropyrrolo[3,4-d]imidazole
CID 118614266

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole?
The IUPAC name of 3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole (CID 118614122) is 3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole.
What is the SMILES notation for 3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole?
The canonical SMILES for 3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole is CCn1c(-c2ccn[nH]2)nc2c1CNC2.
What is the InChIKey of 3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole?
The InChIKey is OGJLSUXNLLDJTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1-2-15-9-6-11-5-8(9)13-10(15)7-3-4-12-14-7/h3-4,11H,2,5-6H2,1H3,(H,12,14).
What are the key properties of 3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole?
3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole has a molecular weight of 203.25 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-(1H-pyrazol-5-yl)-5,6-dihydro-4H-pyrrolo[3,4-d]imidazole is sourced from PubChem (CID 118614122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).