N-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine

C13H18N4 — CID 104731316

IUPACN-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCC(C)c1cc2c(NC3CC3C)nccn2n1
InChIInChI=1S/C13H18N4/c1-8(2)10-7-12-13(15-11-6-9(11)3)14-4-5-17(12)16-10/h4-5,7-9,11H,6H2,1-3H3,(H,14,15)
InChIKeyHPAPEXBFRMLPKC-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.67
Rot. Bonds3

About N-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine

N-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 104731316) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is N-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound NameN-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
PubChem CID104731316
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC NameN-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCC(C)c1cc2c(NC3CC3C)nccn2n1
InChIInChI=1S/C13H18N4/c1-8(2)10-7-12-13(15-11-6-9(11)3)14-4-5-17(12)16-10/h4-5,7-9,11H,6H2,1-3H3,(H,14,15)
InChIKeyHPAPEXBFRMLPKC-UHFFFAOYSA-N
XLogP2.67
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine (CID 104731316) is N-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine is CC(C)c1cc2c(NC3CC3C)nccn2n1.
What is the InChIKey of N-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is HPAPEXBFRMLPKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-8(2)10-7-12-13(15-11-6-9(11)3)14-4-5-17(12)16-10/h4-5,7-9,11H,6H2,1-3H3,(H,14,15).
What are the key properties of N-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine?
N-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 230.31 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclopropyl)-2-propan-2-ylpyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 104731316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).