N-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide

C18H24N2O4S — CID 18146406

IUPACN-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide
SMILESO=C(NC(C1CC1)C1CC1)c1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C18H24N2O4S/c21-18(19-17(13-1-2-13)14-3-4-14)15-5-7-16(8-6-15)25(22,23)20-9-11-24-12-10-20/h5-8,13-14,17H,1-4,9-12H2,(H,19,21)
InChIKeyGMKKREDSXHXDND-UHFFFAOYSA-N
MW364.47 g/mol
LogP1.63
Rot. Bonds6

About N-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide

N-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide (PubChem CID 18146406) has the molecular formula C18H24N2O4S and a molecular weight of 364.47 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide
PubChem CID18146406
Molecular FormulaC18H24N2O4S
Molecular Weight364.47 g/mol
Exact Mass364.15
IUPAC NameN-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide
SMILESO=C(NC(C1CC1)C1CC1)c1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C18H24N2O4S/c21-18(19-17(13-1-2-13)14-3-4-14)15-5-7-16(8-6-15)25(22,23)20-9-11-24-12-10-20/h5-8,13-14,17H,1-4,9-12H2,(H,19,21)
InChIKeyGMKKREDSXHXDND-UHFFFAOYSA-N
XLogP1.63
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.47
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(dicyclopropylmethyl)-4-pyrrolidin-1-ylsulfonylbenzamide
CID 18146405
N-[(1R)-1-(furan-2-yl)ethyl]-4-morpholin-4-ylsulfonylbenzamide
CID 8856521
N-[(1S)-1-(furan-2-yl)ethyl]-4-morpholin-4-ylsulfonylbenzamide
CID 8856511
N-[1-(1-adamantyl)ethyl]-4-morpholin-4-ylsulfonylbenzamide
CID 5051760
4-morpholin-4-ylsulfonyl-N-(oxolan-3-yl)benzamide
CID 110868803
(2S)-4-methyl-2-[(4-morpholin-4-ylsulfonylbenzoyl)amino]pentanoic acid
CID 119361822
N-[(2S)-heptan-2-yl]-4-morpholin-4-ylsulfonylbenzamide
CID 7927777
N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 1152899
N-(4-fluorophenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 1157332
4-iodo-N-(4-morpholin-4-ylsulfonylphenyl)benzamide
CID 3955565
N-[(1R)-1-(2-chlorophenyl)ethyl]-4-morpholin-4-ylsulfonylbenzamide
CID 8700706
N-(3,5-dimethylphenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 1077896

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of N-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide (CID 18146406) is N-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for N-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for N-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide is O=C(NC(C1CC1)C1CC1)c1ccc(S(=O)(=O)N2CCOCC2)cc1.
What is the InChIKey of N-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide?
The InChIKey is GMKKREDSXHXDND-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O4S/c21-18(19-17(13-1-2-13)14-3-4-14)15-5-7-16(8-6-15)25(22,23)20-9-11-24-12-10-20/h5-8,13-14,17H,1-4,9-12H2,(H,19,21).
What are the key properties of N-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide?
N-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide has a molecular weight of 364.47 g/mol, XLogP of 1.63, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-4-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 18146406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).