2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol

C15H21NO3 — CID 82187161

IUPAC2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol
SMILESCC1(C)Oc2ccccc2C(O)C1N1CCOCC1
InChIInChI=1S/C15H21NO3/c1-15(2)14(16-7-9-18-10-8-16)13(17)11-5-3-4-6-12(11)19-15/h3-6,13-14,17H,7-10H2,1-2H3
InChIKeyAQWYILPJCHIKDK-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.59
Rot. Bonds1

About 2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol

2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol (PubChem CID 82187161) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol.

Molecular Properties

Compound Name2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol
PubChem CID82187161
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol
SMILESCC1(C)Oc2ccccc2C(O)C1N1CCOCC1
InChIInChI=1S/C15H21NO3/c1-15(2)14(16-7-9-18-10-8-16)13(17)11-5-3-4-6-12(11)19-15/h3-6,13-14,17H,7-10H2,1-2H3
InChIKeyAQWYILPJCHIKDK-UHFFFAOYSA-N
XLogP1.59
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol?
The IUPAC name of 2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol (CID 82187161) is 2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol.
What is the SMILES notation for 2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol?
The canonical SMILES for 2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol is CC1(C)Oc2ccccc2C(O)C1N1CCOCC1.
What is the InChIKey of 2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol?
The InChIKey is AQWYILPJCHIKDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-15(2)14(16-7-9-18-10-8-16)13(17)11-5-3-4-6-12(11)19-15/h3-6,13-14,17H,7-10H2,1-2H3.
What are the key properties of 2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol?
2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol has a molecular weight of 263.34 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-morpholin-4-yl-3,4-dihydrochromen-4-ol is sourced from PubChem (CID 82187161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).