[1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol

C12H19NO2 — CID 95934404

IUPAC[1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol
SMILESC[C@@H](c1ccco1)N1CCC(CO)CC1
InChIInChI=1S/C12H19NO2/c1-10(12-3-2-8-15-12)13-6-4-11(9-14)5-7-13/h2-3,8,10-11,14H,4-7,9H2,1H3/t10-/m0/s1
InChIKeyKWFUASMUGDQTFW-JTQLQIEISA-N
MW209.29 g/mol
LogP2.04
Rot. Bonds3

About [1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol

[1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol (PubChem CID 95934404) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is [1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol
PubChem CID95934404
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name[1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol
SMILESC[C@@H](c1ccco1)N1CCC(CO)CC1
InChIInChI=1S/C12H19NO2/c1-10(12-3-2-8-15-12)13-6-4-11(9-14)5-7-13/h2-3,8,10-11,14H,4-7,9H2,1H3/t10-/m0/s1
InChIKeyKWFUASMUGDQTFW-JTQLQIEISA-N
XLogP2.04
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(3S)-1-[(1R)-1-(furan-2-yl)ethyl]piperidin-3-yl]methanol
CID 129373082
[(3S)-1-[(1S)-1-(furan-2-yl)ethyl]pyrrolidin-3-yl]methanamine
CID 98085589
1-[1-[1-(furan-2-yl)ethyl]pyrrolidin-3-yl]-N-methylmethanamine
CID 62512099
1-[1-(furan-2-yl)ethyl]pyrrolidin-3-amine
CID 43535712
[1-[2-amino-1-(furan-2-yl)ethyl]pyrrolidin-3-yl]methanol
CID 112624466
2-[1-[1-(furan-2-yl)ethyl]piperidin-4-yl]oxyacetic acid
CID 65065324
[1-[(1S)-1-thiophen-2-ylethyl]piperidin-4-yl]methanol
CID 97175553
[1-[1-(furan-2-yl)propan-2-yl]pyrrolidin-3-yl]methanol
CID 64866259
4-[1-(furan-2-yl)ethyl]thiomorpholine
CID 130749822
(3S)-1-[1-(furan-2-yl)ethyl]piperidin-3-ol
CID 71633408
N-ethyl-1-[1-(furan-2-yl)ethyl]-3-methylpiperidin-4-amine
CID 54975340
[(2S)-1-[(1R)-1-(furan-2-yl)ethyl]pyrrolidin-2-yl]methanamine
CID 129427489

Frequently Asked Questions

What is the IUPAC name of [1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol?
The IUPAC name of [1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol (CID 95934404) is [1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol.
What is the SMILES notation for [1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol?
The canonical SMILES for [1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol is C[C@@H](c1ccco1)N1CCC(CO)CC1.
What is the InChIKey of [1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol?
The InChIKey is KWFUASMUGDQTFW-JTQLQIEISA-N. The full InChI is InChI=1S/C12H19NO2/c1-10(12-3-2-8-15-12)13-6-4-11(9-14)5-7-13/h2-3,8,10-11,14H,4-7,9H2,1H3/t10-/m0/s1.
What are the key properties of [1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol?
[1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol has a molecular weight of 209.29 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol is sourced from PubChem (CID 95934404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).