3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine

C10H17N3 — CID 155691828

IUPAC3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine
SMILESCC(C)(C)c1c(N)nn2c1CCC2
InChIInChI=1S/C10H17N3/c1-10(2,3)8-7-5-4-6-13(7)12-9(8)11/h4-6H2,1-3H3,(H2,11,12)
InChIKeyGFWQDFQKKFLWPO-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.71
Rot. Bonds

About 3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine

3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine (PubChem CID 155691828) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine.

Molecular Properties

Compound Name3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine
PubChem CID155691828
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine
SMILESCC(C)(C)c1c(N)nn2c1CCC2
InChIInChI=1S/C10H17N3/c1-10(2,3)8-7-5-4-6-13(7)12-9(8)11/h4-6H2,1-3H3,(H2,11,12)
InChIKeyGFWQDFQKKFLWPO-UHFFFAOYSA-N
XLogP1.71
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-tert-butyl-2-ethoxy-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole
CID 129293099
3-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a]azepin-2-amine
CID 177339311
3-amino-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
CID 11228995
2-methyl-3-propan-2-yl-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole
CID 170442026
1-(3-ethenyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-yl)-2,2-dimethylpropan-1-one
CID 178046445
(3-methyl-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazol-2-yl)methanol
CID 155019625
2-ethoxy-3-propan-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole
CID 130205037
2,3-ditert-butyl-5-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 164761854
5-tert-butyl-2-methylpyrimidine-4,6-diamine
CID 90873862
3-bromo-2-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 90898270
2-bromo-3-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 83821484
2-cyclopropyl-3-propan-2-yl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole
CID 58720037

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine?
The IUPAC name of 3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine (CID 155691828) is 3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine.
What is the SMILES notation for 3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine?
The canonical SMILES for 3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine is CC(C)(C)c1c(N)nn2c1CCC2.
What is the InChIKey of 3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine?
The InChIKey is GFWQDFQKKFLWPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-10(2,3)8-7-5-4-6-13(7)12-9(8)11/h4-6H2,1-3H3,(H2,11,12).
What are the key properties of 3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine?
3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine has a molecular weight of 179.27 g/mol, XLogP of 1.71, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-2-amine is sourced from PubChem (CID 155691828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).