furan-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone

C12H17NO3 — CID 121200631

IUPACfuran-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone
SMILESO=C(c1ccoc1)N1CCC(CCO)CC1
InChIInChI=1S/C12H17NO3/c14-7-3-10-1-5-13(6-2-10)12(15)11-4-8-16-9-11/h4,8-10,14H,1-3,5-7H2
InChIKeyNBXREZXLWMJSDS-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.51
Rot. Bonds3

About furan-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone

furan-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone (PubChem CID 121200631) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is furan-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Namefuran-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone
PubChem CID121200631
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC Namefuran-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone
SMILESO=C(c1ccoc1)N1CCC(CCO)CC1
InChIInChI=1S/C12H17NO3/c14-7-3-10-1-5-13(6-2-10)12(15)11-4-8-16-9-11/h4,8-10,14H,1-3,5-7H2
InChIKeyNBXREZXLWMJSDS-UHFFFAOYSA-N
XLogP1.51
TPSA53.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(bromomethyl)pyrrolidin-1-yl]-(furan-3-yl)methanone
CID 80666702
N-[3-[3-(2-hydroxyethyl)pyrrolidin-1-yl]-3-oxopropyl]furan-3-carboxamide
CID 115775397
furan-3-yl-[2-(3-hydroxypropyl)pyrrolidin-1-yl]methanone
CID 62468240
furan-3-yl-[(4S)-4-[(4-methylpiperidin-1-yl)methyl]azepan-1-yl]methanone
CID 164629238
1-[[1-(furan-3-carbonyl)piperidin-4-yl]methyl]-3-propylurea
CID 90522000
4-bromo-N-[[1-(furan-3-carbonyl)piperidin-4-yl]methyl]benzamide
CID 90521806
N-[[1-(furan-3-carbonyl)piperidin-4-yl]methyl]-2-thiophen-2-ylacetamide
CID 71786690
N-[1-(furan-3-carbonyl)piperidin-4-yl]-N-methylacetamide
CID 47080410
(3-ethyl-4-hydroxypiperidin-1-yl)-(furan-3-yl)methanone
CID 114509899
[3-(chloromethyl)azetidin-1-yl]-(furan-3-yl)methanone
CID 130531402
4-chloro-N-[[1-(furan-3-carbonyl)piperidin-4-yl]methyl]benzenesulfonamide
CID 90521872
4-fluoro-N-[[1-(furan-3-carbonyl)piperidin-4-yl]methyl]benzenesulfonamide
CID 90521856

Frequently Asked Questions

What is the IUPAC name of furan-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone?
The IUPAC name of furan-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone (CID 121200631) is furan-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone.
What is the SMILES notation for furan-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone?
The canonical SMILES for furan-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone is O=C(c1ccoc1)N1CCC(CCO)CC1.
What is the InChIKey of furan-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone?
The InChIKey is NBXREZXLWMJSDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c14-7-3-10-1-5-13(6-2-10)12(15)11-4-8-16-9-11/h4,8-10,14H,1-3,5-7H2.
What are the key properties of furan-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone?
furan-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone has a molecular weight of 223.27 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-3-yl-[4-(2-hydroxyethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 121200631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).