N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide

C24H26N2O6S — CID 42278728

IUPACN-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide
SMILESCc1cc(C)c2c(=O)cc(C(=O)Nc3ccc(S(=O)(=O)N4C[C@@H](C)O[C@H](C)C4)cc3)oc2c1
InChIInChI=1S/C24H26N2O6S/c1-14-9-15(2)23-20(27)11-22(32-21(23)10-14)24(28)25-18-5-7-19(8-6-18)33(29,30)26-12-16(3)31-17(4)13-26/h5-11,16-17H,12-13H2,1-4H3,(H,25,28)/t16-,17-/m1/s1
InChIKeyOOUNVCQGMHFCKV-IAGOWNOFSA-N
MW470.55 g/mol
LogP3.46
Rot. Bonds4

About N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide

N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide (PubChem CID 42278728) has the molecular formula C24H26N2O6S and a molecular weight of 470.55 g/mol. Its IUPAC name is N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide
PubChem CID42278728
Molecular FormulaC24H26N2O6S
Molecular Weight470.55 g/mol
Exact Mass470.15
IUPAC NameN-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide
SMILESCc1cc(C)c2c(=O)cc(C(=O)Nc3ccc(S(=O)(=O)N4C[C@@H](C)O[C@H](C)C4)cc3)oc2c1
InChIInChI=1S/C24H26N2O6S/c1-14-9-15(2)23-20(27)11-22(32-21(23)10-14)24(28)25-18-5-7-19(8-6-18)33(29,30)26-12-16(3)31-17(4)13-26/h5-11,16-17H,12-13H2,1-4H3,(H,25,28)/t16-,17-/m1/s1
InChIKeyOOUNVCQGMHFCKV-IAGOWNOFSA-N
XLogP3.46
TPSA105.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.55
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide with MolForge

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Related Compounds

5,7-dimethyl-N-[4-[(2R)-2-methylpiperidin-1-yl]sulfonylphenyl]-4-oxochromene-2-carboxamide
CID 40965332
N-[4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-7,8-dimethyl-4-oxochromene-2-carboxamide
CID 40965347
4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(4-sulfamoylphenyl)benzamide
CID 2326585
4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-[3-[[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylbenzoyl]amino]-4-methylphenyl]benzamide
CID 99678549
4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(4-hydroxyphenyl)benzamide
CID 94696380
N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]furan-3-carboxamide
CID 27018677
4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-phenylbenzamide
CID 6463291
4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-phenylbenzamide
CID 40606298
N-[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-1-benzofuran-2-carboxamide
CID 7921841
8-methyl-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-4-oxochromene-2-carboxamide
CID 19119100
N-[4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-1-(3-methylphenyl)-4-oxopyridazine-3-carboxamide
CID 40967362
N-[4-(2,6-dimethylmorpholin-4-yl)sulfonylphenyl]-2-fluorobenzamide
CID 51152550

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide?
The IUPAC name of N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide (CID 42278728) is N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide.
What is the SMILES notation for N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide?
The canonical SMILES for N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide is Cc1cc(C)c2c(=O)cc(C(=O)Nc3ccc(S(=O)(=O)N4C[C@@H](C)O[C@H](C)C4)cc3)oc2c1.
What is the InChIKey of N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide?
The InChIKey is OOUNVCQGMHFCKV-IAGOWNOFSA-N. The full InChI is InChI=1S/C24H26N2O6S/c1-14-9-15(2)23-20(27)11-22(32-21(23)10-14)24(28)25-18-5-7-19(8-6-18)33(29,30)26-12-16(3)31-17(4)13-26/h5-11,16-17H,12-13H2,1-4H3,(H,25,28)/t16-,17-/m1/s1.
What are the key properties of N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide?
N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide has a molecular weight of 470.55 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylphenyl]-5,7-dimethyl-4-oxochromene-2-carboxamide is sourced from PubChem (CID 42278728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).