2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine

C10H16N2O — CID 3162826

IUPAC2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine
SMILESNCC(c1ccco1)N1CCCC1
InChIInChI=1S/C10H16N2O/c11-8-9(10-4-3-7-13-10)12-5-1-2-6-12/h3-4,7,9H,1-2,5-6,8,11H2
InChIKeyUYQVLFHSKHZNKC-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.38
Rot. Bonds3

About 2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine

2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine (PubChem CID 3162826) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine.

Molecular Properties

Compound Name2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine
PubChem CID3162826
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine
SMILESNCC(c1ccco1)N1CCCC1
InChIInChI=1S/C10H16N2O/c11-8-9(10-4-3-7-13-10)12-5-1-2-6-12/h3-4,7,9H,1-2,5-6,8,11H2
InChIKeyUYQVLFHSKHZNKC-UHFFFAOYSA-N
XLogP1.38
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine?
The IUPAC name of 2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine (CID 3162826) is 2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine.
What is the SMILES notation for 2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine?
The canonical SMILES for 2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine is NCC(c1ccco1)N1CCCC1.
What is the InChIKey of 2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine?
The InChIKey is UYQVLFHSKHZNKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c11-8-9(10-4-3-7-13-10)12-5-1-2-6-12/h3-4,7,9H,1-2,5-6,8,11H2.
What are the key properties of 2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine?
2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine has a molecular weight of 180.25 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine is sourced from PubChem (CID 3162826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).