2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol

C15H21NO3 — CID 141416785

IUPAC2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol
SMILESCCCC1c2cc(O)ccc2OC1N1CCOCC1
InChIInChI=1S/C15H21NO3/c1-2-3-12-13-10-11(17)4-5-14(13)19-15(12)16-6-8-18-9-7-16/h4-5,10,12,15,17H,2-3,6-9H2,1H3
InChIKeyHZZXLAKVNPWCEE-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.33
Rot. Bonds3

About 2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol

2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol (PubChem CID 141416785) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol.

Molecular Properties

Compound Name2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol
PubChem CID141416785
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol
SMILESCCCC1c2cc(O)ccc2OC1N1CCOCC1
InChIInChI=1S/C15H21NO3/c1-2-3-12-13-10-11(17)4-5-14(13)19-15(12)16-6-8-18-9-7-16/h4-5,10,12,15,17H,2-3,6-9H2,1H3
InChIKeyHZZXLAKVNPWCEE-UHFFFAOYSA-N
XLogP2.33
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol?
The IUPAC name of 2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol (CID 141416785) is 2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol.
What is the SMILES notation for 2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol?
The canonical SMILES for 2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol is CCCC1c2cc(O)ccc2OC1N1CCOCC1.
What is the InChIKey of 2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol?
The InChIKey is HZZXLAKVNPWCEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-2-3-12-13-10-11(17)4-5-14(13)19-15(12)16-6-8-18-9-7-16/h4-5,10,12,15,17H,2-3,6-9H2,1H3.
What are the key properties of 2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol?
2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol has a molecular weight of 263.34 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-3-propyl-2,3-dihydro-1-benzofuran-5-ol is sourced from PubChem (CID 141416785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).