1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine

C14H23NO — CID 169242230

IUPAC1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine
SMILESCC(C)CC1CCCN(Cc2ccco2)C1
InChIInChI=1S/C14H23NO/c1-12(2)9-13-5-3-7-15(10-13)11-14-6-4-8-16-14/h4,6,8,12-13H,3,5,7,9-11H2,1-2H3
InChIKeyJNIOQDSPNNNGDC-UHFFFAOYSA-N
MW221.34 g/mol
LogP3.54
Rot. Bonds4

About 1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine

1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine (PubChem CID 169242230) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine.

Molecular Properties

Compound Name1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine
PubChem CID169242230
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC Name1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine
SMILESCC(C)CC1CCCN(Cc2ccco2)C1
InChIInChI=1S/C14H23NO/c1-12(2)9-13-5-3-7-15(10-13)11-14-6-4-8-16-14/h4,6,8,12-13H,3,5,7,9-11H2,1-2H3
InChIKeyJNIOQDSPNNNGDC-UHFFFAOYSA-N
XLogP3.54
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[(3R)-1-ethylpiperidin-3-yl]methyl]-4-(furan-2-ylmethyl)piperazine
CID 124842615
3-ethyl-1-(furan-2-ylmethyl)pyrrolidine
CID 130727430
1-[[1-(furan-2-ylmethyl)piperidin-3-yl]methyl]-3-propylurea
CID 56741397
N-[[(3S)-1-(furan-2-ylmethyl)piperidin-3-yl]methyl]-2-pyrrolidin-1-ylacetamide
CID 95200289
1-(furan-2-ylmethyl)pyrrolidin-3-amine;dihydrochloride
CID 53422470
1-(furan-2-ylmethyl)piperidine;methanamine
CID 162741090
(3S)-N,N-diethyl-1-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 764291
N-[2-[(3R)-1-(furan-2-ylmethyl)piperidin-3-yl]ethyl]-1H-pyrrole-2-carboxamide
CID 95223631
1-(furan-2-ylmethyl)-3-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine
CID 53192047
1-[[1-(furan-2-ylmethyl)piperidin-3-yl]methyl]-3-(2-pentan-3-ylpyrazol-3-yl)urea
CID 74241621
N-[[(3R)-1-(furan-2-ylmethyl)piperidin-3-yl]methyl]-4,6-dimethyl-2-oxo-1H-pyridine-3-carboxamide
CID 95191321
1-(furan-2-ylmethyl)-N,N-dimethylpiperidin-4-amine
CID 91664788

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine?
The IUPAC name of 1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine (CID 169242230) is 1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine.
What is the SMILES notation for 1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine?
The canonical SMILES for 1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine is CC(C)CC1CCCN(Cc2ccco2)C1.
What is the InChIKey of 1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine?
The InChIKey is JNIOQDSPNNNGDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-12(2)9-13-5-3-7-15(10-13)11-14-6-4-8-16-14/h4,6,8,12-13H,3,5,7,9-11H2,1-2H3.
What are the key properties of 1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine?
1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine has a molecular weight of 221.34 g/mol, XLogP of 3.54, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethyl)-3-(2-methylpropyl)piperidine is sourced from PubChem (CID 169242230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).