[4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol

C13H21NO2 — CID 115883315

IUPAC[4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol
SMILESCCC1(CO)CCN(Cc2ccoc2)CC1
InChIInChI=1S/C13H21NO2/c1-2-13(11-15)4-6-14(7-5-13)9-12-3-8-16-10-12/h3,8,10,15H,2,4-7,9,11H2,1H3
InChIKeyACRXNQWRXLSCRR-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.26
Rot. Bonds4

About [4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol

[4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol (PubChem CID 115883315) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is [4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol
PubChem CID115883315
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name[4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol
SMILESCCC1(CO)CCN(Cc2ccoc2)CC1
InChIInChI=1S/C13H21NO2/c1-2-13(11-15)4-6-14(7-5-13)9-12-3-8-16-10-12/h3,8,10,15H,2,4-7,9,11H2,1H3
InChIKeyACRXNQWRXLSCRR-UHFFFAOYSA-N
XLogP2.26
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-1-(furan-3-ylmethyl)pyrrolidine-3-carboxylic acid
CID 65064280
1-(furan-3-ylmethyl)-4-phenylpiperidine-4-carboxylic acid
CID 65072209
1-[7-(furan-3-ylmethyl)-1,7-diazaspiro[3.5]nonan-1-yl]ethanone
CID 97412788
[(3S)-1-(furan-3-ylmethyl)-3-(3-methylbut-2-enyl)piperidin-3-yl]methanol
CID 97122464
(3S,4S)-1-(furan-3-ylmethyl)-3-hydroxy-4-propylpiperidine-4-carboxylic acid
CID 135105447
1-tert-butyl-4-(furan-3-ylmethyl)piperazine
CID 159431968
2-[4-(furan-3-ylmethyl)piperazin-1-yl]propanoic acid
CID 65062356
[1-[(4-ethylphenyl)methyl]-4-(pyrrolidin-1-ylmethyl)piperidin-4-yl]methanol
CID 91783379
(3S)-2-acetyl-8-(furan-3-ylmethyl)-2,8-diazaspiro[4.5]decane-3-carboxylic acid
CID 97127460
1-(furan-3-ylmethyl)-3-propylpiperidine-3-carboxylic acid
CID 65068552
(3R)-8-(furan-3-ylmethyl)-N,N-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-amine
CID 97371272
4-[(3,3-diethylpyrrolidin-1-yl)methyl]phenol
CID 82975258

Frequently Asked Questions

What is the IUPAC name of [4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol?
The IUPAC name of [4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol (CID 115883315) is [4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol.
What is the SMILES notation for [4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol?
The canonical SMILES for [4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol is CCC1(CO)CCN(Cc2ccoc2)CC1.
What is the InChIKey of [4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol?
The InChIKey is ACRXNQWRXLSCRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-2-13(11-15)4-6-14(7-5-13)9-12-3-8-16-10-12/h3,8,10,15H,2,4-7,9,11H2,1H3.
What are the key properties of [4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol?
[4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol has a molecular weight of 223.32 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethyl-1-(furan-3-ylmethyl)piperidin-4-yl]methanol is sourced from PubChem (CID 115883315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).