1-(2-methylpyrazol-3-yl)cyclobutan-1-amine

C8H13N3 — CID 82594917

IUPAC1-(2-methylpyrazol-3-yl)cyclobutan-1-amine
SMILESCn1nccc1C1(N)CCC1
InChIInChI=1S/C8H13N3/c1-11-7(3-6-10-11)8(9)4-2-5-8/h3,6H,2,4-5,9H2,1H3
InChIKeyNRWPIUZDTJESSP-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.76
Rot. Bonds1

About 1-(2-methylpyrazol-3-yl)cyclobutan-1-amine

1-(2-methylpyrazol-3-yl)cyclobutan-1-amine (PubChem CID 82594917) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 1-(2-methylpyrazol-3-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name1-(2-methylpyrazol-3-yl)cyclobutan-1-amine
PubChem CID82594917
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name1-(2-methylpyrazol-3-yl)cyclobutan-1-amine
SMILESCn1nccc1C1(N)CCC1
InChIInChI=1S/C8H13N3/c1-11-7(3-6-10-11)8(9)4-2-5-8/h3,6H,2,4-5,9H2,1H3
InChIKeyNRWPIUZDTJESSP-UHFFFAOYSA-N
XLogP0.76
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpyrazol-3-yl)cyclobutan-1-amine?
The IUPAC name of 1-(2-methylpyrazol-3-yl)cyclobutan-1-amine (CID 82594917) is 1-(2-methylpyrazol-3-yl)cyclobutan-1-amine.
What is the SMILES notation for 1-(2-methylpyrazol-3-yl)cyclobutan-1-amine?
The canonical SMILES for 1-(2-methylpyrazol-3-yl)cyclobutan-1-amine is Cn1nccc1C1(N)CCC1.
What is the InChIKey of 1-(2-methylpyrazol-3-yl)cyclobutan-1-amine?
The InChIKey is NRWPIUZDTJESSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-11-7(3-6-10-11)8(9)4-2-5-8/h3,6H,2,4-5,9H2,1H3.
What are the key properties of 1-(2-methylpyrazol-3-yl)cyclobutan-1-amine?
1-(2-methylpyrazol-3-yl)cyclobutan-1-amine has a molecular weight of 151.21 g/mol, XLogP of 0.76, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpyrazol-3-yl)cyclobutan-1-amine is sourced from PubChem (CID 82594917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).