1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine

C13H22N2O — CID 63249658

IUPAC1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine
SMILESCNCC1CCCCN1C(C)c1ccco1
InChIInChI=1S/C13H22N2O/c1-11(13-7-5-9-16-13)15-8-4-3-6-12(15)10-14-2/h5,7,9,11-12,14H,3-4,6,8,10H2,1-2H3
InChIKeyWCZZIYAPCSTUCI-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.41
Rot. Bonds4

About 1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine

1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine (PubChem CID 63249658) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is 1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine
PubChem CID63249658
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine
SMILESCNCC1CCCCN1C(C)c1ccco1
InChIInChI=1S/C13H22N2O/c1-11(13-7-5-9-16-13)15-8-4-3-6-12(15)10-14-2/h5,7,9,11-12,14H,3-4,6,8,10H2,1-2H3
InChIKeyWCZZIYAPCSTUCI-UHFFFAOYSA-N
XLogP2.41
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(2S)-1-[(1R)-1-(furan-2-yl)ethyl]pyrrolidin-2-yl]methanamine
CID 129427489
1-[1-[1-(2-chlorophenyl)ethyl]piperidin-2-yl]-N-methylmethanamine
CID 63249282
1-[1-[1-(furan-2-yl)ethyl]pyrrolidin-3-yl]-N-methylmethanamine
CID 62512099
(1S)-1-(furan-2-yl)-N-[(1-methylpiperidin-2-yl)methyl]ethanamine
CID 81403117
N-methyl-1-[1-[1-(4-methylsulfanylphenyl)ethyl]piperidin-2-yl]methanamine
CID 63249243
1-[1-[1-(4-ethoxyphenyl)ethyl]piperidin-2-yl]-N-methylmethanamine
CID 63249069
N-methyl-1-[1-[1-[3-(trifluoromethyl)phenyl]ethyl]piperidin-2-yl]methanamine
CID 63249107
1-[1-[1-(4-chlorophenyl)ethyl]pyrrolidin-2-yl]-N-methylmethanamine
CID 115316021
(2S)-1-[1-(furan-2-yl)ethyl]pyrrolidine-2-carboxylic acid
CID 110838455
N-methyl-1-[1-(4-phenylbutan-2-yl)piperidin-2-yl]methanamine
CID 63249483
[1-[1-(furan-2-yl)ethyl]piperidin-2-yl] 3-oxobutanoate
CID 70057887
1-[1-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethyl]piperidin-2-yl]-N-methylmethanamine
CID 63754412

Frequently Asked Questions

What is the IUPAC name of 1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine (CID 63249658) is 1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine is CNCC1CCCCN1C(C)c1ccco1.
What is the InChIKey of 1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine?
The InChIKey is WCZZIYAPCSTUCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-11(13-7-5-9-16-13)15-8-4-3-6-12(15)10-14-2/h5,7,9,11-12,14H,3-4,6,8,10H2,1-2H3.
What are the key properties of 1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine?
1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine has a molecular weight of 222.33 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[1-(furan-2-yl)ethyl]piperidin-2-yl]-N-methylmethanamine is sourced from PubChem (CID 63249658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).