1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine

C10H17N3 — CID 63913503

IUPAC1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine
SMILESCc1cc(C)n(CC(N)C2CC2)n1
InChIInChI=1S/C10H17N3/c1-7-5-8(2)13(12-7)6-10(11)9-3-4-9/h5,9-10H,3-4,6,11H2,1-2H3
InChIKeyWCYGBYBGMHILLF-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.24
Rot. Bonds3

About 1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine

1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine (PubChem CID 63913503) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine
PubChem CID63913503
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine
SMILESCc1cc(C)n(CC(N)C2CC2)n1
InChIInChI=1S/C10H17N3/c1-7-5-8(2)13(12-7)6-10(11)9-3-4-9/h5,9-10H,3-4,6,11H2,1-2H3
InChIKeyWCYGBYBGMHILLF-UHFFFAOYSA-N
XLogP1.24
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 ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine?
The IUPAC name of 1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine (CID 63913503) is 1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine.
What is the SMILES notation for 1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine?
The canonical SMILES for 1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine is Cc1cc(C)n(CC(N)C2CC2)n1.
What is the InChIKey of 1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine?
The InChIKey is WCYGBYBGMHILLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-7-5-8(2)13(12-7)6-10(11)9-3-4-9/h5,9-10H,3-4,6,11H2,1-2H3.
What are the key properties of 1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine?
1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine has a molecular weight of 179.27 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(3,5-dimethylpyrazol-1-yl)ethanamine is sourced from PubChem (CID 63913503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).