N-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine

C11H15N5 — CID 103353997

IUPACN-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine
SMILESNC1(CNc2nccn3nccc23)CCC1
InChIInChI=1S/C11H15N5/c12-11(3-1-4-11)8-14-10-9-2-5-15-16(9)7-6-13-10/h2,5-7H,1,3-4,8,12H2,(H,13,14)
InChIKeyCWNKVCOHOJDCAT-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.02
Rot. Bonds3

About N-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine

N-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 103353997) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is N-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound NameN-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine
PubChem CID103353997
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC NameN-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine
SMILESNC1(CNc2nccn3nccc23)CCC1
InChIInChI=1S/C11H15N5/c12-11(3-1-4-11)8-14-10-9-2-5-15-16(9)7-6-13-10/h2,5-7H,1,3-4,8,12H2,(H,13,14)
InChIKeyCWNKVCOHOJDCAT-UHFFFAOYSA-N
XLogP1.02
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine (CID 103353997) is N-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine is NC1(CNc2nccn3nccc23)CCC1.
What is the InChIKey of N-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is CWNKVCOHOJDCAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c12-11(3-1-4-11)8-14-10-9-2-5-15-16(9)7-6-13-10/h2,5-7H,1,3-4,8,12H2,(H,13,14).
What are the key properties of N-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine?
N-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 217.28 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-aminocyclobutyl)methyl]pyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 103353997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).