3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide

C7H9N3O — CID 90829284

IUPAC3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide
SMILESNC(=O)C1=NN2C=CCC2C1
InChIInChI=1S/C7H9N3O/c8-7(11)6-4-5-2-1-3-10(5)9-6/h1,3,5H,2,4H2,(H2,8,11)
InChIKeyLPANSCIZSBNNNT-UHFFFAOYSA-N
MW151.17 g/mol
LogP-0.18
Rot. Bonds1

About 3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide

3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide (PubChem CID 90829284) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is 3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide.

Molecular Properties

Compound Name3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide
PubChem CID90829284
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide
SMILESNC(=O)C1=NN2C=CCC2C1
InChIInChI=1S/C7H9N3O/c8-7(11)6-4-5-2-1-3-10(5)9-6/h1,3,5H,2,4H2,(H2,8,11)
InChIKeyLPANSCIZSBNNNT-UHFFFAOYSA-N
XLogP-0.18
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide?
The IUPAC name of 3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide (CID 90829284) is 3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide.
What is the SMILES notation for 3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide?
The canonical SMILES for 3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide is NC(=O)C1=NN2C=CCC2C1.
What is the InChIKey of 3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide?
The InChIKey is LPANSCIZSBNNNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c8-7(11)6-4-5-2-1-3-10(5)9-6/h1,3,5H,2,4H2,(H2,8,11).
What are the key properties of 3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide?
3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide has a molecular weight of 151.17 g/mol, XLogP of -0.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3a,4-dihydro-3H-pyrrolo[1,2-b]pyrazole-2-carboxamide is sourced from PubChem (CID 90829284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).