3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine

C14H25N3 — CID 114198053

IUPAC3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine
SMILESCC(C)n1nccc1C(N)CCC1CCCC1
InChIInChI=1S/C14H25N3/c1-11(2)17-14(9-10-16-17)13(15)8-7-12-5-3-4-6-12/h9-13H,3-8,15H2,1-2H3
InChIKeyLZZCTGLIDPJLDW-UHFFFAOYSA-N
MW235.38 g/mol
LogP3.43
Rot. Bonds5

About 3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine

3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine (PubChem CID 114198053) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is 3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine.

Molecular Properties

Compound Name3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine
PubChem CID114198053
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC Name3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine
SMILESCC(C)n1nccc1C(N)CCC1CCCC1
InChIInChI=1S/C14H25N3/c1-11(2)17-14(9-10-16-17)13(15)8-7-12-5-3-4-6-12/h9-13H,3-8,15H2,1-2H3
InChIKeyLZZCTGLIDPJLDW-UHFFFAOYSA-N
XLogP3.43
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine?
The IUPAC name of 3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine (CID 114198053) is 3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine.
What is the SMILES notation for 3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine?
The canonical SMILES for 3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine is CC(C)n1nccc1C(N)CCC1CCCC1.
What is the InChIKey of 3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine?
The InChIKey is LZZCTGLIDPJLDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-11(2)17-14(9-10-16-17)13(15)8-7-12-5-3-4-6-12/h9-13H,3-8,15H2,1-2H3.
What are the key properties of 3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine?
3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine has a molecular weight of 235.38 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-amine is sourced from PubChem (CID 114198053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).