[1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol

C18H24N2O2 — CID 91842140

IUPAC[1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol
SMILESOC(c1ccccn1)C1CCN(CCCc2ccco2)CC1
InChIInChI=1S/C18H24N2O2/c21-18(17-7-1-2-10-19-17)15-8-12-20(13-9-15)11-3-5-16-6-4-14-22-16/h1-2,4,6-7,10,14-15,18,21H,3,5,8-9,11-13H2
InChIKeyDBXGNTUWDRLFCB-UHFFFAOYSA-N
MW300.40 g/mol
LogP3.05
Rot. Bonds6

About [1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol

[1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol (PubChem CID 91842140) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is [1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol.

Molecular Properties

Compound Name[1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol
PubChem CID91842140
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name[1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol
SMILESOC(c1ccccn1)C1CCN(CCCc2ccco2)CC1
InChIInChI=1S/C18H24N2O2/c21-18(17-7-1-2-10-19-17)15-8-12-20(13-9-15)11-3-5-16-6-4-14-22-16/h1-2,4,6-7,10,14-15,18,21H,3,5,8-9,11-13H2
InChIKeyDBXGNTUWDRLFCB-UHFFFAOYSA-N
XLogP3.05
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(S)-[1-[3-(furan-2-yl)propyl]piperidin-4-yl]-(1-methylimidazol-2-yl)methanol
CID 124757025
3-[2-[4-[hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]ethyl]-1,3-benzoxazol-2-one
CID 77081794
(R)-[1-[2-(2,4-dimethylphenoxy)ethyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 124751770
3-[2-[4-[(R)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]ethyl]-1H-imidazol-2-one
CID 124750427
[(3S)-1-[3-(furan-2-yl)propyl]piperidin-3-yl]-pyridin-2-ylmethanone
CID 124753964
1-[3-(furan-2-yl)propyl]piperidine
CID 162740839
(R)-[1-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 99933667
3-[2-[4-[hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]ethyl]-6-methyl-1H-pyrimidine-2,4-dione
CID 91832572
N-(3-chlorophenyl)-3-[4-[(S)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]propanamide
CID 124749868
(S)-pyridin-2-yl-[1-(1-tetracyclo[6.6.1.02,7.09,14]pentadeca-2,4,6,9,11,13-hexaenylmethyl)piperidin-4-yl]methanol
CID 67744575
(S)-[1-[(2-cyclohexylpyrimidin-5-yl)methyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 99942839
[1-[(3-ethoxyphenyl)methyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 53193333

Frequently Asked Questions

What is the IUPAC name of [1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol?
The IUPAC name of [1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol (CID 91842140) is [1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol.
What is the SMILES notation for [1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol?
The canonical SMILES for [1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol is OC(c1ccccn1)C1CCN(CCCc2ccco2)CC1.
What is the InChIKey of [1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol?
The InChIKey is DBXGNTUWDRLFCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c21-18(17-7-1-2-10-19-17)15-8-12-20(13-9-15)11-3-5-16-6-4-14-22-16/h1-2,4,6-7,10,14-15,18,21H,3,5,8-9,11-13H2.
What are the key properties of [1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol?
[1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol has a molecular weight of 300.40 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[3-(furan-2-yl)propyl]piperidin-4-yl]-pyridin-2-ylmethanol is sourced from PubChem (CID 91842140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).