2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine

C14H24N2O — CID 55162702

IUPAC2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine
SMILESCCc1ccc(C(CN)N2CCCC2(C)C)o1
InChIInChI=1S/C14H24N2O/c1-4-11-6-7-13(17-11)12(10-15)16-9-5-8-14(16,2)3/h6-7,12H,4-5,8-10,15H2,1-3H3
InChIKeyMFMFBTRHGUXQSS-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.72
Rot. Bonds4

About 2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine

2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine (PubChem CID 55162702) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine.

Molecular Properties

Compound Name2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine
PubChem CID55162702
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine
SMILESCCc1ccc(C(CN)N2CCCC2(C)C)o1
InChIInChI=1S/C14H24N2O/c1-4-11-6-7-13(17-11)12(10-15)16-9-5-8-14(16,2)3/h6-7,12H,4-5,8-10,15H2,1-3H3
InChIKeyMFMFBTRHGUXQSS-UHFFFAOYSA-N
XLogP2.72
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-bromofuran-2-yl)-2-(2,2-dimethylpyrrolidin-1-yl)ethanamine
CID 63219371
2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperazin-1-yl)ethanamine
CID 62344941
2-(5-ethylfuran-2-yl)-2-(4-methylpiperidin-1-yl)ethanamine
CID 62346543
2-(5-ethylfuran-2-yl)-2-(4-propan-2-ylpiperidin-1-yl)ethanamine
CID 103494690
2-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-(5-ethylfuran-2-yl)ethanamine
CID 102725743
2-(3-bromofuran-2-yl)-2-(2,2-dimethylpyrrolidin-1-yl)ethanamine
CID 106885736
2-(5-bromothiophen-2-yl)-2-(2,2-dimethylpyrrolidin-1-yl)ethanamine
CID 63216262
2-(3,5-dichlorophenyl)-2-(2,2-dimethylpyrrolidin-1-yl)ethanamine
CID 63216072
2-(4-cyclopropylphenyl)-2-(2,2-dimethylpyrrolidin-1-yl)ethanamine
CID 79984492
2-(2,2-dimethylpyrrolidin-1-yl)-2-(3-methylthiophen-2-yl)ethanamine
CID 63216264
2-(3-bromophenyl)-2-(2,2-dimethylpyrrolidin-1-yl)ethanamine
CID 63215857
2-(3-chlorophenyl)-2-(2,2-dimethylpyrrolidin-1-yl)ethanamine
CID 63216309

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine?
The IUPAC name of 2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine (CID 55162702) is 2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine.
What is the SMILES notation for 2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine?
The canonical SMILES for 2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine is CCc1ccc(C(CN)N2CCCC2(C)C)o1.
What is the InChIKey of 2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine?
The InChIKey is MFMFBTRHGUXQSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-11-6-7-13(17-11)12(10-15)16-9-5-8-14(16,2)3/h6-7,12H,4-5,8-10,15H2,1-3H3.
What are the key properties of 2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine?
2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine has a molecular weight of 236.36 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpyrrolidin-1-yl)-2-(5-ethylfuran-2-yl)ethanamine is sourced from PubChem (CID 55162702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).