2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine

C11H18N2O — CID 63208703

IUPAC2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine
SMILESCC1CCN(C(CN)c2ccoc2)C1
InChIInChI=1S/C11H18N2O/c1-9-2-4-13(7-9)11(6-12)10-3-5-14-8-10/h3,5,8-9,11H,2,4,6-7,12H2,1H3
InChIKeySXDKLTHSLYJYCH-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.62
Rot. Bonds3

About 2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine

2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine (PubChem CID 63208703) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine.

Molecular Properties

Compound Name2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine
PubChem CID63208703
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine
SMILESCC1CCN(C(CN)c2ccoc2)C1
InChIInChI=1S/C11H18N2O/c1-9-2-4-13(7-9)11(6-12)10-3-5-14-8-10/h3,5,8-9,11H,2,4,6-7,12H2,1H3
InChIKeySXDKLTHSLYJYCH-UHFFFAOYSA-N
XLogP1.62
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(furan-3-yl)-2-(3,4,5-trimethylpiperazin-1-yl)ethanamine
CID 114537409
2-(4-ethoxyphenyl)-2-(3-methylpyrrolidin-1-yl)ethanamine
CID 61224408
2-(3,4-difluorophenyl)-2-(3-methylpyrrolidin-1-yl)ethanamine
CID 61225182
2-(4-cyclopentylpiperazin-1-yl)-2-(furan-3-yl)ethanamine
CID 55163009
(2R)-2-[(3S)-3-methylpiperidin-1-yl]-2-phenylethanamine
CID 9160808
2-(3-methylpyrrolidin-1-yl)-2-[4-(trifluoromethylsulfanyl)phenyl]ethanamine
CID 61225963
2-(2,3-difluorophenyl)-2-(3-methylpyrrolidin-1-yl)ethanamine
CID 63669105
2-(4-ethyl-4-methylpiperidin-1-yl)-2-(furan-3-yl)ethanamine
CID 55163205
2-(2-ethylphenyl)-2-(3-methylpyrrolidin-1-yl)ethanamine
CID 55067304
2-(4,5-dibromofuran-2-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine
CID 62085064
2-(4-fluoro-2-methylphenyl)-2-(3-methylpyrrolidin-1-yl)ethanamine
CID 62134804
2-(4-tert-butylphenyl)-2-(4-methylpiperidin-1-yl)ethanamine
CID 16642740

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine?
The IUPAC name of 2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine (CID 63208703) is 2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine.
What is the SMILES notation for 2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine?
The canonical SMILES for 2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine is CC1CCN(C(CN)c2ccoc2)C1.
What is the InChIKey of 2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine?
The InChIKey is SXDKLTHSLYJYCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-9-2-4-13(7-9)11(6-12)10-3-5-14-8-10/h3,5,8-9,11H,2,4,6-7,12H2,1H3.
What are the key properties of 2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine?
2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine has a molecular weight of 194.28 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-2-(3-methylpyrrolidin-1-yl)ethanamine is sourced from PubChem (CID 63208703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).