1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol

C17H22N2O3 — CID 75382065

IUPAC1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol
SMILESOC(CC1COCCN1CCc1ccncc1)c1ccco1
InChIInChI=1S/C17H22N2O3/c20-16(17-2-1-10-22-17)12-15-13-21-11-9-19(15)8-5-14-3-6-18-7-4-14/h1-4,6-7,10,15-16,20H,5,8-9,11-13H2
InChIKeyYQLCWAZNRLEGPL-UHFFFAOYSA-N
MW302.37 g/mol
LogP2.04
Rot. Bonds6

About 1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol

1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol (PubChem CID 75382065) has the molecular formula C17H22N2O3 and a molecular weight of 302.37 g/mol. Its IUPAC name is 1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol.

Molecular Properties

Compound Name1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol
PubChem CID75382065
Molecular FormulaC17H22N2O3
Molecular Weight302.37 g/mol
Exact Mass302.16
IUPAC Name1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol
SMILESOC(CC1COCCN1CCc1ccncc1)c1ccco1
InChIInChI=1S/C17H22N2O3/c20-16(17-2-1-10-22-17)12-15-13-21-11-9-19(15)8-5-14-3-6-18-7-4-14/h1-4,6-7,10,15-16,20H,5,8-9,11-13H2
InChIKeyYQLCWAZNRLEGPL-UHFFFAOYSA-N
XLogP2.04
TPSA58.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.37
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol?
The IUPAC name of 1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol (CID 75382065) is 1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol.
What is the SMILES notation for 1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol?
The canonical SMILES for 1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol is OC(CC1COCCN1CCc1ccncc1)c1ccco1.
What is the InChIKey of 1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol?
The InChIKey is YQLCWAZNRLEGPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O3/c20-16(17-2-1-10-22-17)12-15-13-21-11-9-19(15)8-5-14-3-6-18-7-4-14/h1-4,6-7,10,15-16,20H,5,8-9,11-13H2.
What are the key properties of 1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol?
1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol has a molecular weight of 302.37 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-2-[4-(2-pyridin-4-ylethyl)morpholin-3-yl]ethanol is sourced from PubChem (CID 75382065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).