[1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine

C11H18N2O — CID 82505300

IUPAC[1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine
SMILESCc1ccc(CN2CCCC2CN)o1
InChIInChI=1S/C11H18N2O/c1-9-4-5-11(14-9)8-13-6-2-3-10(13)7-12/h4-5,10H,2-3,6-8,12H2,1H3
InChIKeyQFCUIMSYMLOXFR-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.51
Rot. Bonds3

About [1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine

[1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine (PubChem CID 82505300) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is [1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine.

Molecular Properties

Compound Name[1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine
PubChem CID82505300
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name[1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine
SMILESCc1ccc(CN2CCCC2CN)o1
InChIInChI=1S/C11H18N2O/c1-9-4-5-11(14-9)8-13-6-2-3-10(13)7-12/h4-5,10H,2-3,6-8,12H2,1H3
InChIKeyQFCUIMSYMLOXFR-UHFFFAOYSA-N
XLogP1.51
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 ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]propan-2-ol
CID 115883125
2-methyl-1-[(5-methylfuran-2-yl)methyl]pyrrolidine
CID 130718603
5-[[2-(aminomethyl)pyrrolidin-1-yl]methyl]furan-2-carboxylic acid
CID 115312700
[(2R)-1-(furan-2-ylmethyl)pyrrolidin-2-yl]methanamine
CID 94011431
2-[1-[(5-methylfuran-2-yl)methyl]piperidin-2-yl]acetic acid
CID 54899724
[1-[(5-methylthiophen-2-yl)methyl]pyrrolidin-2-yl]methanamine
CID 115311784
2-[(2R)-4-cyclobutyl-1-[(5-methylfuran-2-yl)methyl]piperazin-2-yl]ethanol
CID 98580104
[1-[(2,3-dimethylphenyl)methyl]pyrrolidin-2-yl]methanamine
CID 115311614
[(2S)-1-benzylpyrrolidin-2-yl]methanamine;hydrochloride
CID 22856183
[(2S)-1-[(4-iodophenyl)methyl]pyrrolidin-2-yl]methanamine
CID 90478034
[1-[(2,4,6-trimethylphenyl)methyl]pyrrolidin-2-yl]methanamine;hydrochloride
CID 119927229
[1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanamine
CID 115311630

Frequently Asked Questions

What is the IUPAC name of [1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine?
The IUPAC name of [1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine (CID 82505300) is [1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine.
What is the SMILES notation for [1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine?
The canonical SMILES for [1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine is Cc1ccc(CN2CCCC2CN)o1.
What is the InChIKey of [1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine?
The InChIKey is QFCUIMSYMLOXFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-9-4-5-11(14-9)8-13-6-2-3-10(13)7-12/h4-5,10H,2-3,6-8,12H2,1H3.
What are the key properties of [1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine?
[1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine has a molecular weight of 194.28 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(5-methylfuran-2-yl)methyl]pyrrolidin-2-yl]methanamine is sourced from PubChem (CID 82505300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).