2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine

C14H24N2O — CID 113416920

IUPAC2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine
SMILESCC(C)(C)C1CCN(C(CN)c2ccco2)C1
InChIInChI=1S/C14H24N2O/c1-14(2,3)11-6-7-16(10-11)12(9-15)13-5-4-8-17-13/h4-5,8,11-12H,6-7,9-10,15H2,1-3H3
InChIKeyWFONISARAHFEGP-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.65
Rot. Bonds3

About 2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine

2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine (PubChem CID 113416920) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine.

Molecular Properties

Compound Name2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine
PubChem CID113416920
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine
SMILESCC(C)(C)C1CCN(C(CN)c2ccco2)C1
InChIInChI=1S/C14H24N2O/c1-14(2,3)11-6-7-16(10-11)12(9-15)13-5-4-8-17-13/h4-5,8,11-12H,6-7,9-10,15H2,1-3H3
InChIKeyWFONISARAHFEGP-UHFFFAOYSA-N
XLogP2.65
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(furan-2-yl)-2-(3-methoxypyrrolidin-1-yl)ethanamine
CID 103530810
1-[2-amino-1-(furan-2-yl)ethyl]-4-methylpiperidin-3-ol
CID 102956003
[1-[2-amino-1-(furan-2-yl)ethyl]pyrrolidin-3-yl]methanol
CID 112624466
2-(furan-2-yl)-2-(4-propylpiperidin-1-yl)ethanamine
CID 55050220
2-(3-ethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
CID 43584299
1-[2-amino-1-(furan-2-yl)ethyl]azetidin-3-ol
CID 131207499
2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-(furan-2-yl)ethanamine
CID 79931766
2-(4-benzylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
CID 43346331
2-(4-tert-butyl-3,6-dihydro-2H-pyridin-1-yl)-2-(furan-2-yl)ethanamine
CID 114462182
2-[1-[2-amino-1-(furan-2-yl)ethyl]piperidin-4-yl]oxyethanol
CID 82696071
[(3S)-1-[(1S)-1-(furan-2-yl)ethyl]pyrrolidin-3-yl]methanamine
CID 98085589
2-(4,4-diethylpiperidin-1-yl)-2-(furan-2-yl)ethanamine
CID 63156988

Frequently Asked Questions

What is the IUPAC name of 2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine?
The IUPAC name of 2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine (CID 113416920) is 2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine.
What is the SMILES notation for 2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine?
The canonical SMILES for 2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine is CC(C)(C)C1CCN(C(CN)c2ccco2)C1.
What is the InChIKey of 2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine?
The InChIKey is WFONISARAHFEGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-14(2,3)11-6-7-16(10-11)12(9-15)13-5-4-8-17-13/h4-5,8,11-12H,6-7,9-10,15H2,1-3H3.
What are the key properties of 2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine?
2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine has a molecular weight of 236.36 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-tert-butylpyrrolidin-1-yl)-2-(furan-2-yl)ethanamine is sourced from PubChem (CID 113416920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).