2-(2-cyclobutylpyrazol-3-yl)propan-1-amine

C10H17N3 — CID 83875236

IUPAC2-(2-cyclobutylpyrazol-3-yl)propan-1-amine
SMILESCC(CN)c1ccnn1C1CCC1
InChIInChI=1S/C10H17N3/c1-8(7-11)10-5-6-12-13(10)9-3-2-4-9/h5-6,8-9H,2-4,7,11H2,1H3
InChIKeyCIQYZUILEDKBNI-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.67
Rot. Bonds3

About 2-(2-cyclobutylpyrazol-3-yl)propan-1-amine

2-(2-cyclobutylpyrazol-3-yl)propan-1-amine (PubChem CID 83875236) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 2-(2-cyclobutylpyrazol-3-yl)propan-1-amine.

Molecular Properties

Compound Name2-(2-cyclobutylpyrazol-3-yl)propan-1-amine
PubChem CID83875236
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name2-(2-cyclobutylpyrazol-3-yl)propan-1-amine
SMILESCC(CN)c1ccnn1C1CCC1
InChIInChI=1S/C10H17N3/c1-8(7-11)10-5-6-12-13(10)9-3-2-4-9/h5-6,8-9H,2-4,7,11H2,1H3
InChIKeyCIQYZUILEDKBNI-UHFFFAOYSA-N
XLogP1.67
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclobutylpyrazol-3-yl)propan-1-amine?
The IUPAC name of 2-(2-cyclobutylpyrazol-3-yl)propan-1-amine (CID 83875236) is 2-(2-cyclobutylpyrazol-3-yl)propan-1-amine.
What is the SMILES notation for 2-(2-cyclobutylpyrazol-3-yl)propan-1-amine?
The canonical SMILES for 2-(2-cyclobutylpyrazol-3-yl)propan-1-amine is CC(CN)c1ccnn1C1CCC1.
What is the InChIKey of 2-(2-cyclobutylpyrazol-3-yl)propan-1-amine?
The InChIKey is CIQYZUILEDKBNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-8(7-11)10-5-6-12-13(10)9-3-2-4-9/h5-6,8-9H,2-4,7,11H2,1H3.
What are the key properties of 2-(2-cyclobutylpyrazol-3-yl)propan-1-amine?
2-(2-cyclobutylpyrazol-3-yl)propan-1-amine has a molecular weight of 179.27 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclobutylpyrazol-3-yl)propan-1-amine is sourced from PubChem (CID 83875236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).