1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol

C15H21NO3 — CID 54065514

IUPAC1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol
SMILESCC1(O)CCc2c(OCC3CNCCO3)cccc21
InChIInChI=1S/C15H21NO3/c1-15(17)6-5-12-13(15)3-2-4-14(12)19-10-11-9-16-7-8-18-11/h2-4,11,16-17H,5-10H2,1H3
InChIKeyMCQVEDQDPWTJCU-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.21
Rot. Bonds3

About 1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol

1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol (PubChem CID 54065514) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol.

Molecular Properties

Compound Name1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol
PubChem CID54065514
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol
SMILESCC1(O)CCc2c(OCC3CNCCO3)cccc21
InChIInChI=1S/C15H21NO3/c1-15(17)6-5-12-13(15)3-2-4-14(12)19-10-11-9-16-7-8-18-11/h2-4,11,16-17H,5-10H2,1H3
InChIKeyMCQVEDQDPWTJCU-UHFFFAOYSA-N
XLogP1.21
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol?
The IUPAC name of 1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol (CID 54065514) is 1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol.
What is the SMILES notation for 1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol?
The canonical SMILES for 1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol is CC1(O)CCc2c(OCC3CNCCO3)cccc21.
What is the InChIKey of 1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol?
The InChIKey is MCQVEDQDPWTJCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-15(17)6-5-12-13(15)3-2-4-14(12)19-10-11-9-16-7-8-18-11/h2-4,11,16-17H,5-10H2,1H3.
What are the key properties of 1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol?
1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol has a molecular weight of 263.34 g/mol, XLogP of 1.21, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(morpholin-2-ylmethoxy)-2,3-dihydroinden-1-ol is sourced from PubChem (CID 54065514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).