2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen

C10H19N3 — CID 170573510

IUPAC2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen
SMILESCC(C)(C)c1cc2n(n1)CCNC2.[H][H]
InChIInChI=1S/C10H17N3.H2/c1-10(2,3)9-6-8-7-11-4-5-13(8)12-9;/h6,11H,4-5,7H2,1-3H3;1H
InChIKeyXAGIRYMFZUAXPF-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.53
Rot. Bonds

About 2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen

2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen (PubChem CID 170573510) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is 2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen.

Molecular Properties

Compound Name2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen
PubChem CID170573510
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC Name2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen
SMILESCC(C)(C)c1cc2n(n1)CCNC2.[H][H]
InChIInChI=1S/C10H17N3.H2/c1-10(2,3)9-6-8-7-11-4-5-13(8)12-9;/h6,11H,4-5,7H2,1-3H3;1H
InChIKeyXAGIRYMFZUAXPF-UHFFFAOYSA-N
XLogP1.53
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 83694497
2-(trifluoromethyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine
CID 83882205
2-bromo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 84670414
5-methyl-2-[2-methyl-2-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl)propyl]-1,3-benzothiazole
CID 146572797
2-(trifluoromethyl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepine;dihydrochloride
CID 170999765
2-[[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]methyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 56888635
N-ethyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)ethanamine
CID 129415771
2-cyclopropyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;dihydrochloride
CID 112756425
5-tert-butyl-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-1,3,4-oxadiazol-2-amine
CID 72898288
2-tert-butyl-5-cyclopropyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 142538383
2-tert-butyl-5-ethyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazine
CID 122646722
2-pentan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 131991238

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen?
The IUPAC name of 2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen (CID 170573510) is 2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen.
What is the SMILES notation for 2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen?
The canonical SMILES for 2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen is CC(C)(C)c1cc2n(n1)CCNC2.[H][H].
What is the InChIKey of 2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen?
The InChIKey is XAGIRYMFZUAXPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3.H2/c1-10(2,3)9-6-8-7-11-4-5-13(8)12-9;/h6,11H,4-5,7H2,1-3H3;1H.
What are the key properties of 2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen?
2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen has a molecular weight of 181.28 g/mol, XLogP of 1.53, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine;molecular hydrogen is sourced from PubChem (CID 170573510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).