[5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone

C24H25NO6 — CID 66987585

IUPAC[5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone
SMILESCOc1cc(C(=O)c2cc(-c3ccco3)ccc2N2CCOCC2)cc(OC)c1OC
InChIInChI=1S/C24H25NO6/c1-27-21-14-17(15-22(28-2)24(21)29-3)23(26)18-13-16(20-5-4-10-31-20)6-7-19(18)25-8-11-30-12-9-25/h4-7,10,13-15H,8-9,11-12H2,1-3H3
InChIKeyAXHOCGZFMYONRQ-UHFFFAOYSA-N
MW423.47 g/mol
LogP4.04
Rot. Bonds7

About [5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone

[5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone (PubChem CID 66987585) has the molecular formula C24H25NO6 and a molecular weight of 423.47 g/mol. Its IUPAC name is [5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone.

Molecular Properties

Compound Name[5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone
PubChem CID66987585
Molecular FormulaC24H25NO6
Molecular Weight423.47 g/mol
Exact Mass423.17
IUPAC Name[5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone
SMILESCOc1cc(C(=O)c2cc(-c3ccco3)ccc2N2CCOCC2)cc(OC)c1OC
InChIInChI=1S/C24H25NO6/c1-27-21-14-17(15-22(28-2)24(21)29-3)23(26)18-13-16(20-5-4-10-31-20)6-7-19(18)25-8-11-30-12-9-25/h4-7,10,13-15H,8-9,11-12H2,1-3H3
InChIKeyAXHOCGZFMYONRQ-UHFFFAOYSA-N
XLogP4.04
TPSA70.37 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.47
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

[2-(3-aminopyrrolidin-1-yl)-5-(furan-2-yl)phenyl]-(3,4,5-trimethoxyphenyl)methanone
CID 66987812
[2-[3-(dimethylamino)pyrrolidin-1-yl]-5-(furan-2-yl)phenyl]-(3,4,5-trimethoxyphenyl)methanone
CID 66987409
4-[4-(furan-2-yl)-2-methoxyphenyl]morpholine
CID 168525030
[5-(furan-2-yl)-2-nitrophenyl]-(3,4,5-trimethoxyphenyl)methanone
CID 25064957
propyl 5-(furan-2-yl)-2-morpholin-4-ylbenzoate
CID 168526053
[4-(furan-2-yl)-2-(3,4,5-trimethoxybenzoyl)phenyl] trifluoromethanesulfonate
CID 87225986
4-(furan-2-yl)-2-methoxybenzoic acid
CID 53224787
[4-(furan-2-yl)-1-pyrimidin-5-ylpyrrol-3-yl]-(3,4,5-trimethoxyphenyl)methanone
CID 171343056
[4-(furan-2-yl)-2,6-dimethoxyphenyl] benzoate
CID 58431996
4-[2-(furan-2-yl)-4-methylphenyl]morpholine
CID 168526395
(E)-N-(2-morpholin-4-ylphenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
CID 7922277
5-[2-(3-bromo-4,5-dimethoxyphenyl)ethyl]-2-morpholin-4-ylbenzoic acid
CID 161349189

Frequently Asked Questions

What is the IUPAC name of [5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone?
The IUPAC name of [5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone (CID 66987585) is [5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone.
What is the SMILES notation for [5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone?
The canonical SMILES for [5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone is COc1cc(C(=O)c2cc(-c3ccco3)ccc2N2CCOCC2)cc(OC)c1OC.
What is the InChIKey of [5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone?
The InChIKey is AXHOCGZFMYONRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO6/c1-27-21-14-17(15-22(28-2)24(21)29-3)23(26)18-13-16(20-5-4-10-31-20)6-7-19(18)25-8-11-30-12-9-25/h4-7,10,13-15H,8-9,11-12H2,1-3H3.
What are the key properties of [5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone?
[5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone has a molecular weight of 423.47 g/mol, XLogP of 4.04, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(furan-2-yl)-2-morpholin-4-ylphenyl]-(3,4,5-trimethoxyphenyl)methanone is sourced from PubChem (CID 66987585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).