2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine

C17H28N4 — CID 66139830

IUPAC2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine
SMILESNCC(c1cncn1C1CC1)N1CCCC1C1CCCC1
InChIInChI=1S/C17H28N4/c18-10-16(17-11-19-12-21(17)14-7-8-14)20-9-3-6-15(20)13-4-1-2-5-13/h11-16H,1-10,18H2
InChIKeyARPCXZQGYKJBKG-UHFFFAOYSA-N
MW288.44 g/mol
LogP2.87
Rot. Bonds5

About 2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine

2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine (PubChem CID 66139830) has the molecular formula C17H28N4 and a molecular weight of 288.44 g/mol. Its IUPAC name is 2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine
PubChem CID66139830
Molecular FormulaC17H28N4
Molecular Weight288.44 g/mol
Exact Mass288.23
IUPAC Name2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine
SMILESNCC(c1cncn1C1CC1)N1CCCC1C1CCCC1
InChIInChI=1S/C17H28N4/c18-10-16(17-11-19-12-21(17)14-7-8-14)20-9-3-6-15(20)13-4-1-2-5-13/h11-16H,1-10,18H2
InChIKeyARPCXZQGYKJBKG-UHFFFAOYSA-N
XLogP2.87
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine?
The IUPAC name of 2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine (CID 66139830) is 2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine.
What is the SMILES notation for 2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine?
The canonical SMILES for 2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine is NCC(c1cncn1C1CC1)N1CCCC1C1CCCC1.
What is the InChIKey of 2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine?
The InChIKey is ARPCXZQGYKJBKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4/c18-10-16(17-11-19-12-21(17)14-7-8-14)20-9-3-6-15(20)13-4-1-2-5-13/h11-16H,1-10,18H2.
What are the key properties of 2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine?
2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine has a molecular weight of 288.44 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopentylpyrrolidin-1-yl)-2-(3-cyclopropylimidazol-4-yl)ethanamine is sourced from PubChem (CID 66139830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).