N-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide

C23H28N2O5 — CID 146316426

IUPACN-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide
SMILESCCN(C(=O)c1cc(C(C)C)c(O)cc1O)c1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C23H28N2O5/c1-4-25(23(29)18-13-17(15(2)3)20(26)14-21(18)27)19-8-6-5-7-16(19)22(28)24-9-11-30-12-10-24/h5-8,13-15,26-27H,4,9-12H2,1-3H3
InChIKeyRUUOUVJBAUTULX-UHFFFAOYSA-N
MW412.49 g/mol
LogP3.36
Rot. Bonds5

About N-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide

N-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide (PubChem CID 146316426) has the molecular formula C23H28N2O5 and a molecular weight of 412.49 g/mol. Its IUPAC name is N-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide.

Molecular Properties

Compound NameN-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide
PubChem CID146316426
Molecular FormulaC23H28N2O5
Molecular Weight412.49 g/mol
Exact Mass412.20
IUPAC NameN-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide
SMILESCCN(C(=O)c1cc(C(C)C)c(O)cc1O)c1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C23H28N2O5/c1-4-25(23(29)18-13-17(15(2)3)20(26)14-21(18)27)19-8-6-5-7-16(19)22(28)24-9-11-30-12-10-24/h5-8,13-15,26-27H,4,9-12H2,1-3H3
InChIKeyRUUOUVJBAUTULX-UHFFFAOYSA-N
XLogP3.36
TPSA90.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.49
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-N-(3-fluorophenyl)-2,4-dihydroxy-5-propan-2-ylbenzamide
CID 146316508
(2,4-dihydroxy-5-propan-2-ylphenyl)-(7-morpholin-4-yl-3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 143655097
[1-(2-hydroxy-4-propan-2-ylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 47051901
3-[2-hydroxy-3-(morpholine-4-carbonyl)anilino]-4-[[(1R)-1-(5-methyl-4-propan-2-ylfuran-2-yl)propyl]amino]cyclobut-3-ene-1,2-dione
CID 23648965
ethyl 2-(1,4,7-trioxa-10-azacyclododecane-10-carbonyl)benzoate
CID 15945097
(4-chloro-2-hydroxyphenyl)-[4-(1-morpholin-4-ylethyl)piperidin-1-yl]methanone
CID 56904274
N-[2-(morpholine-4-carbonyl)phenyl]-2,4-bis(phenylmethoxy)-5-propan-2-ylbenzamide
CID 146316459
2-(morpholine-4-carbonyl)-N,N-diphenylbenzamide
CID 1217065
N-(3-morpholin-4-ylpropyl)-2-propan-2-ylbenzamide
CID 143519809
2-(3-methyl-4-propan-2-ylphenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
CID 35326706
2-[methyl(1,4-oxazepane-4-carbonyl)amino]benzoic acid
CID 62968689
(2,5-dihydroxyphenyl)-(1,4-oxazepan-4-yl)methanone
CID 107722952

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide?
The IUPAC name of N-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide (CID 146316426) is N-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide.
What is the SMILES notation for N-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide?
The canonical SMILES for N-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide is CCN(C(=O)c1cc(C(C)C)c(O)cc1O)c1ccccc1C(=O)N1CCOCC1.
What is the InChIKey of N-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide?
The InChIKey is RUUOUVJBAUTULX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O5/c1-4-25(23(29)18-13-17(15(2)3)20(26)14-21(18)27)19-8-6-5-7-16(19)22(28)24-9-11-30-12-10-24/h5-8,13-15,26-27H,4,9-12H2,1-3H3.
What are the key properties of N-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide?
N-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide has a molecular weight of 412.49 g/mol, XLogP of 3.36, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,4-dihydroxy-N-[2-(morpholine-4-carbonyl)phenyl]-5-propan-2-ylbenzamide is sourced from PubChem (CID 146316426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).