2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine

C11H20N4 — CID 51619177

IUPAC2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine
SMILESCc1cc([C@H]2CCCN2CCN)nn1C
InChIInChI=1S/C11H20N4/c1-9-8-10(13-14(9)2)11-4-3-6-15(11)7-5-12/h8,11H,3-7,12H2,1-2H3/t11-/m1/s1
InChIKeyZVGJRHARHXXZJH-LLVKDONJSA-N
MW208.31 g/mol
LogP0.82
Rot. Bonds3

About 2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine

2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine (PubChem CID 51619177) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine
PubChem CID51619177
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine
SMILESCc1cc([C@H]2CCCN2CCN)nn1C
InChIInChI=1S/C11H20N4/c1-9-8-10(13-14(9)2)11-4-3-6-15(11)7-5-12/h8,11H,3-7,12H2,1-2H3/t11-/m1/s1
InChIKeyZVGJRHARHXXZJH-LLVKDONJSA-N
XLogP0.82
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine?
The IUPAC name of 2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine (CID 51619177) is 2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine.
What is the SMILES notation for 2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine?
The canonical SMILES for 2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine is Cc1cc([C@H]2CCCN2CCN)nn1C.
What is the InChIKey of 2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine?
The InChIKey is ZVGJRHARHXXZJH-LLVKDONJSA-N. The full InChI is InChI=1S/C11H20N4/c1-9-8-10(13-14(9)2)11-4-3-6-15(11)7-5-12/h8,11H,3-7,12H2,1-2H3/t11-/m1/s1.
What are the key properties of 2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine?
2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine has a molecular weight of 208.31 g/mol, XLogP of 0.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-2-(1,5-dimethylpyrazol-3-yl)pyrrolidin-1-yl]ethanamine is sourced from PubChem (CID 51619177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).