3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine

C15H27N5 — CID 66777223

IUPAC3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine
SMILESCCn1nc(C(CN2CCCC2)N2CCCC2)cc1N
InChIInChI=1S/C15H27N5/c1-2-20-15(16)11-13(17-20)14(19-9-5-6-10-19)12-18-7-3-4-8-18/h11,14H,2-10,12,16H2,1H3
InChIKeySYPXRUJKVYAOMT-UHFFFAOYSA-N
MW277.42 g/mol
LogP1.72
Rot. Bonds5

About 3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine

3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine (PubChem CID 66777223) has the molecular formula C15H27N5 and a molecular weight of 277.42 g/mol. Its IUPAC name is 3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine.

Molecular Properties

Compound Name3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine
PubChem CID66777223
Molecular FormulaC15H27N5
Molecular Weight277.42 g/mol
Exact Mass277.23
IUPAC Name3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine
SMILESCCn1nc(C(CN2CCCC2)N2CCCC2)cc1N
InChIInChI=1S/C15H27N5/c1-2-20-15(16)11-13(17-20)14(19-9-5-6-10-19)12-18-7-3-4-8-18/h11,14H,2-10,12,16H2,1H3
InChIKeySYPXRUJKVYAOMT-UHFFFAOYSA-N
XLogP1.72
TPSA50.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.42
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine?
The IUPAC name of 3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine (CID 66777223) is 3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine.
What is the SMILES notation for 3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine?
The canonical SMILES for 3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine is CCn1nc(C(CN2CCCC2)N2CCCC2)cc1N.
What is the InChIKey of 3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine?
The InChIKey is SYPXRUJKVYAOMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5/c1-2-20-15(16)11-13(17-20)14(19-9-5-6-10-19)12-18-7-3-4-8-18/h11,14H,2-10,12,16H2,1H3.
What are the key properties of 3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine?
3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine has a molecular weight of 277.42 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,2-dipyrrolidin-1-ylethyl)-1-ethylpyrazol-5-amine is sourced from PubChem (CID 66777223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).